HAPSITEER高级操作培训课件

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1、HAPSITE ER/Smart Plus TrainingHAPSITE ER/Smart Plus 培培 训训 Advanced ER IQ/Plus IQ 高级的 ER IQ/Plus IQ 2Copyright 20082HAPSITEER高级操作培训Course Outline 课程大纲课程大纲 Overview 综述综述 Instrument Setup 仪器设置仪器设置 Tune 调谐调谐 Troubleshooting 故障查找故障查找 Advanced Data Review 高级数据处理高级数据处理 Creating AMDIS Libraries 创建创建 AMDIS 库

2、库 Recognizing Co-Elution 识别共淘析识别共淘析 Chromatogram Overlay 色谱图迭加色谱图迭加 Accessing Quantitation Reports 查访定量报告查访定量报告 Basic Method Writing 基本方法编写基本方法编写 Method Editor Overview 方法编写器概述方法编写器概述 SIM Methods SIM 方法方法 Method Sequencing 方法序列方法序列 Blank Subtraction 空样扣除空样扣除 Communications 通讯通讯3Copyright 20083HAPSIT

3、EER高级操作培训Instrument Setup 仪器设置仪器设置 Insert Gas Canisters 插入气瓶插入气瓶 Turn on the Analytical Module or take the Analytical Module out of Extended Standby 将将分析模件电源分析模件电源 on 或将分析模件离开延伸的待机状态或将分析模件离开延伸的待机状态 System will heat,AutoTune and run a Concentrator cleanout 系统将加热系统将加热,自动调谐和运行浓缩器清理自动调谐和运行浓缩器清理 Turn on

4、the Laptop 将计算机电源将计算机电源 on Double click the ER IQ/Plus IQ icon to open the software 双击双击 ER IQ/Plus IQ 图标图标,打开软件打开软件 4Copyright 20084HAPSITEER高级操作培训Tune 调谐调谐 Tune Overview 调谐概述调谐概述 AutoTune 自动调谐自动调谐 Manual Tune 手动调谐手动调谐5Copyright 20085HAPSITEER高级操作培训Tune Overview 调谐概述调谐概述 Tune optimizes the performa

5、nce of the MS 调谐使调谐使 MS 的性能最佳化的性能最佳化 An improperly tuned MS can result in:未正确调谐的未正确调谐的 MS 可导致可导致:Low sensitivity 灵敏度低灵敏度低 Undetected compounds 未能检测到化合物未能检测到化合物 Mass misalignment 质量数未对准质量数未对准 Incorrect identifications 不正确的不正确的 ID 鉴别鉴别 Incorrect Mass Ratios 不正确的质量比不正确的质量比 Low Net Fit or SI numbers 低纯拟

6、合或低纯拟合或 SI 数数6Copyright 20086HAPSITEER高级操作培训Tune Overview 调谐概述调谐概述 Ten masses are used when tuning the MS 调谐调谐 MS 使用使用 10 个质量数个质量数 Masses are between 50-282 to encompass the full 41-300 range of mass fragments 质量数在质量数在 50-282 之间包含整个之间包含整个 41-300 质量分裂物范围质量分裂物范围 The Internal Standard gas contains the

7、chemicals that provide these masses used for tuning 内部标准气体包含提供这些用于调谐质量数的化合物内部标准气体包含提供这些用于调谐质量数的化合物7Copyright 20087HAPSITEER高级操作培训AutoTune 自动调谐自动调谐 The HAPSITE will automatically AutoTune:HAPSITE 将自动调谐将自动调谐:Upon Startup 当启动时当启动时 Upon exiting Extended Standby 当退出延伸的待机状态时当退出延伸的待机状态时 After 12 hours of o

8、peration运行运行 12 个小时后个小时后8Copyright 20088HAPSITEER高级操作培训AutoTune 自动调谐自动调谐 AutoTune can be initialized by:自动调谐可由下列动作起始自动调谐可由下列动作起始:Clicking Tune AutoTune on the laptop 在计算机上单击在计算机上单击 Tune AutoTune Touching RUN AUTOTUNE on the front panel 触摸面板上的触摸面板上的 RUN AUTOTUNE 按钮按钮 Rebooting the HAPSITE 重新启动重新启动 HA

9、PSITE9Copyright 20089HAPSITEER高级操作培训Troubleshooting a Failed AutoTune 不成功自动调谐的故障查找不成功自动调谐的故障查找 Internal Standard Canister 内部标准气瓶内部标准气瓶 Verify that the pressure is adequate 核实压强是否适当核实压强是否适当 Verify the expiration date 核实是否已到使用期限核实是否已到使用期限 Insert new IS canister if necessary 必要时插入新的必要时插入新的 IS 气瓶气瓶 Carr

10、ier Gas(Smart Plus Only)载气载气(仅仅 Smart Plus)Verify pressure that the pressure is adequate 核实压强是否适当核实压强是否适当 Reservoir pressure (400 kPa)贮存器压强贮存器压强(400 仟帕仟帕)ER does not have a reservoir ER 无贮存器无贮存器 Insert new Carrier Gas canister if necessary 必要时插入新的载气必要时插入新的载气瓶瓶 Repeat AutoTune 重新执行自动调谐重新执行自动调谐10Copyr

11、ight 200810HAPSITEER高级操作培训Tune Requires Advanced Mode 调谐要求高级模式调谐要求高级模式 The Access Level must be set to Advanced to manually tune the instrument 必须将必须将 Access Level 设定于高级设定于高级,手动调谐仪器手动调谐仪器 Set Access Level is used to change the ER IQ/Plus IQ user mode Set Access Level 用于更改用于更改 ER IQ/Plus IQ 的用户模式的用户模

12、式 Normal Mode:Allows access to default methods and data analysis 常规模式常规模式:允许进入默认方法和数据分析允许进入默认方法和数据分析 Advanced Mode:Allows access to method editing,manual tuning,and 高级模式高级模式:允许进入方法编写允许进入方法编写,手动调谐手动调谐,文件传送和文件删除文件传送和文件删除11Copyright 200811HAPSITEER高级操作培训ER IQ/Plus IQ Set Access LevelER IQ/Plus IQ 设定查访层

13、次设定查访层次 Select Set Access Level 选选 Set Access Level Select Advanced from the drop down menu 从下拉菜单上选从下拉菜单上选 Advanced Neither access level is password protected under the default settings 默认设定查访层次无口令保护默认设定查访层次无口令保护 Advanced mode can be password protected if desired 必要时可用口令保护高级模式必要时可用口令保护高级模式 Click OK

14、单击单击 OK12Copyright 200812HAPSITEER高级操作培训Set Access Level 设定查访层次设定查访层次13Copyright 200813HAPSITEER高级操作培训Manual Tune 手动调谐手动调谐 Double click the Tune icon 双击双击调谐调谐图标图标 Select 选选 default.tun Click OK 单击单击 OK Note:The NEG is being consumed while Manual Tune is open 注注:在打开手动调谐的在打开手动调谐的同时同时,消耗消耗 NEG14Copyrig

15、ht 200814HAPSITEER高级操作培训Base Peak Gain(BPG)基峰增益基峰增益(BPG)BPG is related to the intensity of mass 117 BPG 与与 M 117 的强度有关的强度有关 BPG influences sensitivity BPG 影响灵敏度影响灵敏度 ER ideal setting is 0.5 ER 理想的设定值为理想的设定值为 0.5 Range is 0.4 to 0.6 范围为范围为 0.4 至至 0.6 Smart Plus ideal setting is 1.0 Smart Plus理想的设定值为理

16、想的设定值为 0.1 Range is 0.8 to 2.0 范围为范围为 0.8 至至 2.0 15Copyright 200815HAPSITEER高级操作培训Adjusting Base Peak Gain调整基峰增益调整基峰增益 The BPG is adjusted using EM(Electron Multiplier)voltage 用用 EM(电子倍增器电子倍增器)电压调整电压调整 BPG Adjust using increments of 25 V 用增量用增量 25 伏调整伏调整 The normal operating range is 1000 to 2000 vo

17、lts 常规工作范围为常规工作范围为 1000 至至 2000 伏伏 16Copyright 200816HAPSITEER高级操作培训Adjusting Base Peak Gain(BPG)调整基峰增益调整基峰增益(BPG)Adjusted Base Peak Gain for an ER 为为 ER 调整基峰增益调整基峰增益17Copyright 200817HAPSITEER高级操作培训Real Time Mass Calibration Table实时质量校准表实时质量校准表 Red boxes may be present in the Real Time Mass Calibra

18、tion Area 在实时质量校准区可出现红色框在实时质量校准区可出现红色框 This indicates that resolution and/or intensity of the mass is out of range 这表明质量数的分辨率和这表明质量数的分辨率和/或强度已超出范围或强度已超出范围18Copyright 200818HAPSITEER高级操作培训Status Column 状态栏状态栏 Status Column will read OK,OK Low,OK High,Low or High 状态栏将出现状态栏将出现 OK,OK 低低,OK 高高,低低 或或 高等读值

19、高等读值 High and Low are not acceptable 高和低是不可接受的高和低是不可接受的 19Copyright 200819HAPSITEER高级操作培训Mass Alignment 质量对准质量对准 Perform a Mass Alignment by pressing F5 按按 F5 执行质量对准执行质量对准 Updates the Status column readings 更新状态栏读值更新状态栏读值 Perform a Mass Alignment prior to and after making adjustments to the tune par

20、ameters 调整调谐参数前和后执行质量对准调整调谐参数前和后执行质量对准20Copyright 200820HAPSITEER高级操作培训Target Resolution 靶分辨率靶分辨率 Resolution refers to the width of the mass 分辨率与质量数的宽度有关分辨率与质量数的宽度有关 The mass width should be 1 AMU 质量数宽度应为质量数宽度应为 1 AMU The range for the Target Resolution is 0.85 and 1.10 靶靶分辨率的范围在分辨率的范围在 0.85 至至 1.10

21、 之间之间21Copyright 200821HAPSITEER高级操作培训Adjusting Target Resolution 调整靶分辨率调整靶分辨率 Adjust in increments of 0.05 调整的增量为调整的增量为 0.05 The number in the Actual Percentage column is affected by the target resolution adjustments 实际百分数栏的数受靶分辨率调整的影响实际百分数栏的数受靶分辨率调整的影响 It should fall between the Max.and Min.Target

22、s 它应落入最大和最小靶之间它应落入最大和最小靶之间 If the masses cannot be brought into range by adjusting the Target Resolution,adjust the Ion Energies 如调整靶分辨率不能使质量数进入范围如调整靶分辨率不能使质量数进入范围,调整离子能量调整离子能量22Copyright 200822HAPSITEER高级操作培训Ion Energies 离子能量离子能量 Adjusting the Ion Energy adjusts the intensity(height)of the mass 调整离

23、子能量调整质量的强度调整离子能量调整质量的强度(高度高度)Adjust the Ion Energies if the target resolution is at 0.85 and the red box continues to indicate that the mass is above the maximum target resolution 如靶分辨率在如靶分辨率在 0.85 和红框继续表示质量在最大靶分辨率以上和红框继续表示质量在最大靶分辨率以上,调整调整离子能量离子能量 Adjust the Ion Energies if the target resolution is

24、at 1.10 and the red box continues to indicate that the mass is below the minimum target resolution 如靶分辨率在如靶分辨率在 1.10 和红框继续表示质量在最小靶分辨率以下和红框继续表示质量在最小靶分辨率以下,调整调整离子能量离子能量23Copyright 200823HAPSITEER高级操作培训Ion Energies 离子能量离子能量 Adjust the Ion Energy 调整离子能量调整离子能量 Ion Energies should generally be in ascendin

25、g order from Low to High 一般离子能量应从低至高地向一般离子能量应从低至高地向上升上升 Perform a Mass Alignment(F5)after each change until OK is reported in the Status column 每次更改后执行质量对准每次更改后执行质量对准(F5),直到状态栏内显示直到状态栏内显示 OK24Copyright 200824HAPSITEER高级操作培训Save Tune 保存调谐保存调谐 Verify that OK is displayed in the Status Column 核实在状态栏内显示

26、核实在状态栏内显示 OK Readjustment of the BPG,Target Resolution and Ion Energies may be necessary to attain acceptable tune parameters 重重新调整新调整 BPG,靶分辨率和靶分辨率和离子能量可能必须达到可离子能量可能必须达到可接受的调谐参数接受的调谐参数 Click Save Tune 单击单击保存调谐保存调谐 Close Manual Tune 关闭关闭手动调谐手动调谐25Copyright 200825HAPSITEER高级操作培训How to Manual Tune 如何手

27、动调谐如何手动调谐 Verify Mass 117 is in range 核实核实 M 117 在范围内在范围内 Target Resolution(0.85-1.10)靶分辨率靶分辨率(0.85-1.10)Ion Energy(140-170)离子能量离子能量(140-170)Adjust Base Peak Gain(BPG)sensitivity,if needed 如需要如需要,调整基峰增益调整基峰增益(BPG)灵敏度灵敏度 Adjust using EM voltage 用用 EM 电压调整电压调整 Range 范围范围 0.6-0.8 for ER with 0.5 as opt

28、imal setting 对对 ER 0.6-0.8,0.5为最佳设定值为最佳设定值 0.8-2.0 for Smart Plus with 1.0 as optimal setting 对对 Smart Plus 0.8-2.0,1.0为最佳设定值为最佳设定值 Adjust peak width resolutions,if needed如需要如需要,调整峰宽分辨率调整峰宽分辨率 Adjust using Target Resolution 用靶分辨率调整用靶分辨率调整 Range 0.85-1.10 范围范围 0.85-1.10 Adjust mass ratio intensity,if

29、 needed如需要如需要,调整质量比强度调整质量比强度 Adjust using Ion Energy 用离子能量调整用离子能量调整 Refer to Ion Energy range chart 参阅离子能量范围图表参阅离子能量范围图表 Save tune as default.tun 保存调谐为保存调谐为 default.tun26Copyright 200826HAPSITEER高级操作培训 Tune Worksheet 调谐工作表调谐工作表27Copyright 200827HAPSITEER高级操作培训 Advanced Manual Tune Worksheet 高级的手动调谐工

30、作表高级的手动调谐工作表28Copyright 200828HAPSITEER高级操作培训Troubleshooting 故障查找故障查找 Common Problems 常见问题常见问题 High Pressure Troubleshooting 高压强故障查找高压强故障查找29Copyright 200829HAPSITEER高级操作培训Common Problems:High Internal Standard TIC常见问题常见问题:内部标准内部标准 TIC 高高 Possible causes 可能原因可能原因 Blocked air flow in probe 探头中空气流堵塞探头

31、中空气流堵塞 Sample bag closed 样品袋关闭样品袋关闭 Plugged exhaust 排气阻塞排气阻塞 Note:The air peak is not present in the chromatogram 注注:色谱图中未出现空气峰色谱图中未出现空气峰30Copyright 200830HAPSITEER高级操作培训Common Problems:Shifted Retention Time常见问题常见问题:移位的滞留时间移位的滞留时间 A blank may show that the Retention time has shifted 空样可表示滞留时间已移位空样可

32、表示滞留时间已移位Smart Plus BPFB range is 8:00(+/-10 seconds)Smart Plus BPFB 的范围为的范围为 8:00(+/-10 秒秒)ER BPFB range is 3:45 (+/-5 seconds)ER BPFB 的范围为的范围为 3:45(+/-5 秒秒)Adjusting the GC column pressure will adjust the Retention time 调整调整 GC 柱压强将调整滞留时间柱压强将调整滞留时间 GC Column Pressure settings are unique to each HA

33、PSITE 每台每台 HAPSITE 的的 GC 柱压强是柱压强是独特的独特的31Copyright 200831HAPSITEER高级操作培训Common Problems:Shifted Retention Time 常见问题常见问题:移位的滞留时间移位的滞留时间 Double click on the Status icon 双击双击状态状态图标图标 Click 单击单击 Pressure Flow and Offsets Increase kPa to decrease RT 增大仟帕来减小增大仟帕来减小RT 1 kPa change 3 second RT change 更改更改1

34、仟帕仟帕 RT更改更改3 秒秒 Re-run the blank to verify that RT for BPFB is corrected 重新运行空样重新运行空样,证实证实BPFB的的RT已改正已改正32Copyright 200832HAPSITEER高级操作培训Common Problems:Multiple Internal Standard Peaks 常见问题常见问题:多个内部标准峰多个内部标准峰 Occurs when the previous run is aborted 当先前的运行被中止时发生当先前的运行被中止时发生 The Internal Standards we

35、re unable to elute内部标准不能淘析内部标准不能淘析 Continue running blanks until the extra peaks are no longer present 继续运行空样直到额外的峰不再出现继续运行空样直到额外的峰不再出现33Copyright 200833HAPSITEER高级操作培训Common Problems:GC Column Hardware Error常见问题常见问题:GC 柱硬件误差柱硬件误差 Possible causes include:可能的原因包括可能的原因包括:Empty or low nitrogen canister

36、 氮瓶空或压力低氮瓶空或压力低 Insert a new,full can of nitrogen 插入新的插入新的,满的氮瓶满的氮瓶 A cracked or chipped Concentrator 浓缩器破裂或碎裂浓缩器破裂或碎裂 Uninstall the Concentrator to verify its condition 卸下浓缩器卸下浓缩器,核实它的情况核实它的情况 Incorrect ferrule orientation 套圈方向不正确套圈方向不正确 Orient ferrules as shown in picture 套圈方向如图所示套圈方向如图所示 Ferrules

37、 are old or warped 套圈老化或弯曲套圈老化或弯曲 Verify the condition of the ferrules 核实套圈的情况核实套圈的情况 The Concentrator is improperly seated 浓缩器就位不正确浓缩器就位不正确 Reinstall the Concentrator 重新安装浓缩器重新安装浓缩器 The Concentrator nuts are not fully tightened 浓缩器螺帽未完全拧紧浓缩器螺帽未完全拧紧34Copyright 200834HAPSITEER高级操作培训Pump Failure:High

38、Pressure Warning泵损坏泵损坏:高压强警告高压强警告 A high pressure warning appears when the total MS pressure is higher than acceptable 当当 MS 的总压强高于可接受的压强时出现高压强警告的总压强高于可接受的压强时出现高压强警告 Acceptable pressure is less than 6 E-3 Pa可接受的压强低于可接受的压强低于6 E-3 帕帕 The HAPSITE will no longer run methods HAPSITE不再运行方法不再运行方法 The sourc

39、e of the high pressure can be isolated using the Service Module 可用服务模件隔离高压强源可用服务模件隔离高压强源 Attach and pump down for a couple of hours连接和抽空数小时连接和抽空数小时 If the HAPSITE runs a method,the cause is the NEG Pump 如如 HAPSITE 运行方法运行方法,原因在于原因在于 NEG 泵泵 If the HAPSITE does not run a method,the cause is the Ion Pum

40、p 如如 HAPSITE 不运行方法不运行方法,原因在于离子泵原因在于离子泵35Copyright 200835HAPSITEER高级操作培训Pump Overview 泵概述泵概述 Ion Pump离子泵离子泵 Works in conjunction with the NEG to maintain vacuum in the Mass Spectrometer 与与 NEG 一起工作维持质谱仪一起工作维持质谱仪 的真空的真空 Removes the noble gases 清除惰性气体清除惰性气体 Average lifetime of an Ion Pump is 2000 to 40

41、00 hours离子泵的平均寿命为离子泵的平均寿命为 2000 至至 4000 小时小时 To view the Ion Pump hours:查看离子泵的小时数查看离子泵的小时数 Double click the Status icon双击状态图标双击状态图标 Select Maintenance 选选维护维护36Copyright 200836HAPSITEER高级操作培训Pump Overview 泵概述泵概述 NEG Pump NEG 泵泵 Maintains vacuum 维护真空维护真空 NEG can last over 200 hours when stored in Exte

42、nded Standby 当贮存于延伸的待机模式时当贮存于延伸的待机模式时,NEG 可在可在 200 小时以上小时以上 Storing in Extended Standby improves NEG life 贮存于延伸的待机模式可延长贮存于延伸的待机模式可延长 NEG寿命寿命 To view the NEG hours 查看查看 NEG 的小时数的小时数 Double click Status icon 双击状态图标双击状态图标 Click on the NEG Status Tab37Copyright 200837HAPSITEER高级操作培训High Pressure Trouble

43、shooting 高压强故障查找高压强故障查找 NEG bakeout NEG 烘烤烘烤 NEG bakeout can be used if a NEG has less than 100 hours of“On Time”如如 NEG 的的“On Time”时间少于时间少于 100 小时小时,可使用可使用 NEG 烘烤烘烤 The NEG is heated to 700C for 2 hours 将将 NEG 加热至加热至 700C,保持保持 2 个小时个小时 A bakeout may prolong NEG life,but is not a guarantee 烘烤可烘烤可 延长延

44、长 NEG 的寿命的寿命,但不保证但不保证38Copyright 200838HAPSITEER高级操作培训NEG Bakeout NEG 烘烤烘烤 Double click the Status Icon 双击双击状态状态图标图标 Click on Service 单击单击服务服务 Click on Bakeout NEG 单击单击烘烤烘烤 NEG39Copyright 200839HAPSITEER高级操作培训High Pressure in the HAPSITEAttach to Service Module and pump down for 2 hoursRun a method.

45、Does the method run?High pressure was caused by ion pump failureHigh pressure is caused by NEG pump failureAre there a lot of hours on the NEG pump?Replace the NEG pumpBakeout the NEG pumpYESNONOYESFlowchart for High Pressure Troubleshooting40Copyright 200840HAPSITEER高级操作培训高压强在 HAPSITE 中连接至 服务模件 抽空

46、2 个小时运行方法.方法是否 运行?高压强的原因 是由于 离子泵故障高压强的原因是由于 NEG 泵故障NEG 泵是否还有许多 小时数?更换更换 NEG 泵烘烤烘烤 NEG 泵是是否否否否是是高压强故障查找流程图高压强故障查找流程图41Copyright 200841HAPSITEER高级操作培训Advanced Data Review 高级数据处理高级数据处理 Creating AMDIS Libraries 创建创建 AMDIS 库库 Using New AMDIS Library 使用新的使用新的 AMDIS 库库 Recognizing Co-Elution 识别共淘析识别共淘析 Chr

47、omatogram Overlay 色谱图迭加色谱图迭加 Chromatogram Subtract 色谱图扣除色谱图扣除42Copyright 200842HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 To create an AMDIS library 为创建为创建 AMDIS 库库 Select a spectrum from the NIST library 从从 NIST 库选谱图库选谱图 Export the spectrum to a new folder 输出谱图至新文件夹输出谱图至新文件夹 Create libra

48、ry file 创建库文件创建库文件 Add library to AMDIS 添加库至添加库至 AMDIS43Copyright 200843HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 In this example,we will create a library that will include only CWAs 本例中本例中,我们将创建仅包含我们将创建仅包含 CWAs 的库的库 We will add the following compounds:将添加下列化合物将添加下列化合物:Ethylmethylphospho

49、nofluoridate(VX)乙基甲基膦酰基氟化物乙基甲基膦酰基氟化物(VX)Isobutylmethylphosphonofluoridate(R-33)异丁基甲基膦酰基氟化物异丁基甲基膦酰基氟化物(R-33)Sarin 沙林沙林 Soman 束曼束曼 Tabun 塔崩塔崩 Mustard Gas(Sulfur Mustard)芥子气芥子气(硫芥子气硫芥子气)Cyclohexylmethylphosphonofluoridate(Cyclosarin)环己基甲基膦酰基氟化物环己基甲基膦酰基氟化物(环沙林环沙林)44Copyright 200844HAPSITEER高级操作培训Creatin

50、g AMDIS Libraries 创建创建 AMDIS 库库 Open NIST 打开打开 NIST Enter the desired compound 键入所需的化合物键入所需的化合物 EnterEthylmethylphosphonofluoridate(as much as will fit)键入键入乙基甲基膦酰基氟化物乙基甲基膦酰基氟化物(尽管多将拟合尽管多将拟合)Right-click on the highlighted name 右击点亮的名称右击点亮的名称 Click Export Selected 单击单击输出已选输出已选45Copyright 200845HAPSITE

51、ER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Enter VX as the 在文件名中键入在文件名中键入 VX This is the will be entered into the new library 这是将输这是将输入新库的文件入新库的文件 Click Save 单击单击 保存保存46Copyright 200846HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Type Isobutylmethylphosphonofluoridate 键入键入异丁基甲基膦酰基氟化物异丁基

52、甲基膦酰基氟化物 Right-click on the name,and select Export Selected 右击名称右击名称,并选并选输出已选输出已选47Copyright 200847HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Click on VX 单击单击VX Click on Save 单击单击保存保存48Copyright 200848HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Click Append 单击单击 添加添加 This will s

53、ave the selected compound to the same library that VX is saved to 这将保存所选的化合物至与保存这将保存所选的化合物至与保存 VX 相同的库相同的库 Repeat the previous steps until all desired compounds have been added 重复先前的步骤直到全部所需的化合物已经被添加重复先前的步骤直到全部所需的化合物已经被添加 Make sure to click on VX each time 务必每次单击务必每次单击 VX49Copyright 200849HAPSITEER高

54、级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Open the data be analyzed 打开要分析的数据文件打开要分析的数据文件 In the Basic Training Chromatograms-ER folder,open the data Agents 在在基本培训色谱图基本培训色谱图-ER 文件夹文件夹中中,打开标签为打开标签为 Agents 的数据文件的数据文件50Copyright 200850HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Open AMDIS 打开

55、打开 AMDIS Right-click in the chromatogram 在色谱图上右击在色谱图上右击 Highlight Peaks 点亮峰点亮峰 Highlight Switch to AMDIS 点亮点亮 切换至切换至 AMDIS51Copyright 200851HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Click Confirm 单击单击 确认确认 This will open up the Confirmation page(see next slide)这将开启确认页面这将开启确认页面(见下一个幻灯片见下一

56、个幻灯片)52Copyright 200852HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库53Copyright 200853HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 In the Menu bar select Library,then select Library Transfer 在菜单栏中选在菜单栏中选 库库,然后选然后选 库传送库传送54Copyright 200854HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建

57、AMDIS 库库 Click on Files 单击单击 文件文件 Click on Load Library 单击单击 加载库加载库55Copyright 200855HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Change the to.msp 将文件类型更改为将文件类型更改为.msp 56Copyright 200856HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Find the earlier from NIST 从从 NIST 寻找早期保存的文件寻找早期保存

58、的文件 Click the Up One Level button to get to the main NIST folder 单击单击 返回返回上一级文件夹上一级文件夹 按钮按钮,进入主进入主 NIST 文件夹文件夹57Copyright 200857HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Double-click the MSSEARCH folder 双击双击 MSSEARCH 文件夹文件夹 Highlight the compound to add to the library 点亮化合物点亮化合物,将它添加至库中将

59、它添加至库中 This example is VX 本例为本例为 VX Click Open 单击单击 打开打开58Copyright 200858HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Click Create New Library 单击单击 创建新库创建新库59Copyright 200859HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 In,type CWA Library.msl 在在文件名文件名中中,键入键入 CWA Library.msl This i

60、s the name of the new library that is being created 这是创建的新库名这是创建的新库名 Click OK 单击单击 OK Click Close in the Files window 单击单击 在在文件文件窗口中窗口中关闭关闭60Copyright 200860HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Hold Ctrl button on the keyboard and click each compound to highlight 按住键盘上的按住键盘上的 Ctrl 按

61、钮按钮,单击每个化合物单击每个化合物,点亮它们点亮它们 Click Transfer to add to the new CWA Library 单击单击 传送传送,添加至新的添加至新的 CWA 库中库中61Copyright 200861HAPSITEER高级操作培训Creating AMDIS Libraries 创建创建 AMDIS 库库 Click Exit 单击单击 退出退出 This will save the spectra to the new library 这将保存谱线至新库中这将保存谱线至新库中62Copyright 200862HAPSITEER高级操作培训Change

62、 to New AMDIS Library 变换至新变换至新 AMDIS 库库 To change to the new AMDIS Library 为变换至新为变换至新 AMDIS 库库 In the Menu bar click File,then Go to Results 在菜单栏中单击在菜单栏中单击文件文件,接着单击接着单击 前往结果前往结果 This will bring up the Results page 这将调出结果页面这将调出结果页面63Copyright 200863HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新

63、AMDIS 库库 Click on Analyze 单击单击 分析分析64Copyright 200864HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 Click on Target Library 单击单击 靶库靶库65Copyright 200865HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 Click on Select New 单击单击 选新的选新的66Copyright 200866HAPSITEER高级操作培训Change to

64、New AMDIS Library 变换至新变换至新 AMDIS 库库 Click on the Up One Level button until the C:directory appears 单击返回上一级文件夹按钮直到出现单击返回上一级文件夹按钮直到出现 C:目录目录67Copyright 200867HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 Double-click on the NIST08 folder 双击双击 NIST08 文件夹文件夹 Double-click on the MSSEARCH f

65、older 双击双击 MSSEARCH 文件夹文件夹68Copyright 200868HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 Click on Files of type,and select MS Library(*.MSL)单击单击文件类型文件类型,并选并选 MS 库库(*.MSL)69Copyright 200869HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 Click on CWA Library.msl 单击单击 CWA L

66、ibrary.msl Click Open 单击单击 打开打开70Copyright 200870HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 Click Save 单击单击 保存保存71Copyright 200871HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 Click Run 单击单击 运行运行72Copyright 200872HAPSITEER高级操作培训Change to New AMDIS Library 变换至新变换至新 AMDIS 库库 The CWA Library is now the main AMDIS library 现在现在 CWA 库是主库是主 AMDIS 库库73Copyright 200873HAPSITEER高级操作培训Recognizing Co-Elution 识别共淘析识别共淘析 Co-elution occurs when two or more chemicals share the s