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10043_M27

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DataCite Commons2025-01-17 更新2025-04-16 收录
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This dataset contains NMR spectra obtained for the sample -10043_M27 date: 2019-10-19T02:13:39.000Z isFt: true name: 10043_M27/20 phc0: -131.62 phc1: 0 type: NMR Spectrum DECIM: 2080 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TopSpin 4.0.5 DSPFVS: 21 nucleus: 1H reverse: false solvent: DMSO dimension: 1 increment: null isComplex: true probeName: Z151284_0001 (CP QCI 600S3 H/P/C-N-D-05 Z) experiment: 1d groupDelay: 76 temperature: 298.0012 spectrumSize: 65536 baseFrequency: 600.17 fieldStrength: 14.095949804745555 numberOfScans: 16 pulseSequence: zg30 spectralWidth: 16.0209895665619 numberOfPoints: 1 relaxationTime: 5 acquisitionTime: 0 frequencyOffset: 4201.1900000034075 originFrequency: 600.17420119 pulseStrength90: 31250 experimentNumber: 20 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2019-10-19T02:44:51.000Z isFt: true name: 10043_M27/21 phc0: -221.1239,0 phc1: 16.41016,0 type: NMR Spectrum DECIM: 2080 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 4.0.5 DSPFVS: 20 nucleus: 1H,13C reverse: false,false solvent: DMSO dimension: 2 increment: null isComplex: false probeName: Z151284_0001 (CP QCI 600S3 H/P/C-N-D-05 Z) experiment: hsqc groupDelay: 68 temperature: 298.0007 spectrumSize: 1024,1024 baseFrequency: 600.17,150.912866534 fieldStrength: 14.095949804745555 numberOfScans: 4 pulseSequence: hsqcedetgpsisp2.3 spectralWidth: 16.0209895665619,180.049189498831 numberOfPoints: 1 relaxationTime: 2 acquisitionTime: 0 frequencyOffset: 4201.1900000034075,12073.029000021052 originFrequency: 600.17420119,150.924939563 pulseStrength90: 31250 experimentNumber: 21 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2019-10-04T17:31:13.000Z isFt: true name: 10043_M27/0 phc0: -87.82 phc1: 0 type: NMR Spectrum DECIM: 2080 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TopSpin 4.0.5 DSPFVS: 21 nucleus: 1H reverse: false solvent: DMSO dimension: 1 increment: null isComplex: true probeName: Z151284_0001 (CP QCI 600S3 H/P/C-N-D-05 Z) experiment: 1d groupDelay: 76 temperature: 298.0017 spectrumSize: 65536 baseFrequency: 600.17 fieldStrength: 14.095949804745555 numberOfScans: 16 pulseSequence: zg30 spectralWidth: 16.0209895665619 numberOfPoints: 1 relaxationTime: 5 acquisitionTime: 0 frequencyOffset: 4201.1900000034075 originFrequency: 600.17420119 pulseStrength90: 31250 experimentNumber: 0 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2019-10-25T18:37:28.000Z isFt: true name: 10043_M27/0 phc0: -260.32 phc1: 0 type: NMR Spectrum DECIM: 1680 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TopSpin 4.0.5 DSPFVS: 21 nucleus: 1H reverse: false solvent: DMSO dimension: 1 increment: null isComplex: true probeName: Z151284_0001 (CP QCI 600S3 H/P/C-N-D-05 Z) experiment: noesy groupDelay: 76 temperature: 298.002 spectrumSize: 65536 baseFrequency: 600.17 fieldStrength: 14.095949804745555 numberOfScans: 16 pulseSequence: noesyigld1d spectralWidth: 19.8355208096248 numberOfPoints: 1 relaxationTime: 10 acquisitionTime: 0 frequencyOffset: 3901.105000068128 originFrequency: 600.173901105 pulseStrength90: 26232.948583420777 experimentNumber: 0 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1

本数据集包含以下核磁共振谱(NMR Spectrum)数据: 1. 日期:2019-10-19T02:13:39.000Z;是否傅里叶变换:是;名称:10043_M27/20;相位校正0:-131.62;相位校正1:0;类型:核磁共振谱;抽取因子:2080;采集模式:3;是否自由感应衰减信号:否;时间域偏移:0;标题:参数文件,TopSpin 4.0.5;数字信号处理固件版本:21;核素:¹H;是否反转:否;溶剂:二甲基亚砜(DMSO);维度:1;增量:空;是否复信号:是;探头名称:Z151284_0001(CP QCI 600S3 H/P/C-N-D-05 Z);实验类型:一维;群延迟:76;温度:298.0012;光谱大小:65536;基频:600.17;场强:14.095949804745555;扫描次数:16;脉冲序列:zg30;光谱宽度:16.0209895665619;点数:1;弛豫时间:5;采集时间:0;频率偏移:4201.1900000034075;原始频率:600.17420119;90度脉冲强度:31250;实验编号:20;线性预测区间:0;线性预测系数数量:0;窗函数乘法模式:1 2. 日期:2019-10-19T02:44:51.000Z;是否傅里叶变换:是;名称:10043_M27/21;相位校正0:-221.1239,0;相位校正1:16.41016,0;类型:核磁共振谱;抽取因子:2080;采集模式:3;是否自由感应衰减信号:否;时间域偏移:0,0;标题:参数文件,TopSpin 4.0.5;数字信号处理固件版本:20;核素:¹H、¹³C;是否反转:否,否;溶剂:二甲基亚砜;维度:2;增量:空;是否复信号:否;探头名称:Z151284_0001(CP QCI 600S3 H/P/C-N-D-05 Z);实验类型:异核单量子相干谱(HSQC);群延迟:68;温度:298.0007;光谱大小:1024,1024;基频:600.17、150.912866534;场强:14.095949804745555;扫描次数:4;脉冲序列:hsqcedetgpsisp2.3;光谱宽度:16.0209895665619、180.049189498831;点数:1;弛豫时间:2;采集时间:0;频率偏移:4201.1900000034075、12073.029000021052;原始频率:600.17420119、150.924939563;90度脉冲强度:31250;实验编号:21;采集方案:回波-反回波(Echo-antiecho);线性预测区间:0,0;线性预测系数数量:0,0;窗函数乘法模式:4,4 3. 日期:2019-10-04T17:31:13.000Z;是否傅里叶变换:是;名称:10043_M27/0;相位校正0:-87.82;相位校正1:0;类型:核磁共振谱;抽取因子:2080;采集模式:3;是否自由感应衰减信号:否;时间域偏移:0;标题:参数文件,TopSpin 4.0.5;数字信号处理固件版本:21;核素:¹H;是否反转:否;溶剂:二甲基亚砜;维度:1;增量:空;是否复信号:是;探头名称:Z151284_0001(CP QCI 600S3 H/P/C-N-D-05 Z);实验类型:一维;群延迟:76;温度:298.0017;光谱大小:65536;基频:600.17;场强:14.095949804745555;扫描次数:16;脉冲序列:zg30;光谱宽度:16.0209895665619;点数:1;弛豫时间:5;采集时间:0;频率偏移:4201.1900000034075;原始频率:600.17420119;90度脉冲强度:31250;实验编号:0;线性预测区间:0;线性预测系数数量:0;窗函数乘法模式:1 4. 日期:2019-10-25T18:37:28.000Z;是否傅里叶变换:是;名称:10043_M27/0;相位校正0:-260.32;相位校正1:0;类型:核磁共振谱;抽取因子:1680;采集模式:3;是否自由感应衰减信号:否;时间域偏移:0;标题:参数文件,TopSpin 4.0.5;数字信号处理固件版本:21;核素:¹H;是否反转:否;溶剂:二甲基亚砜;维度:1;增量:空;是否复信号:是;探头名称:Z151284_0001(CP QCI 600S3 H/P/C-N-D-05 Z);实验类型:核欧沃豪斯效应谱(NOESY);群延迟:76;温度:298.002;光谱大小:65536;基频:600.17;场强:14.095949804745555;扫描次数:16;脉冲序列:noesyigld1d;光谱宽度:19.8355208096248;点数:1;弛豫时间:10;采集时间:0;频率偏移:3901.105000068128;原始频率:600.173901105;90度脉冲强度:26232.948583420777;实验编号:0;线性预测区间:0;线性预测系数数量:0;窗函数乘法模式:1
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nmrXiv
创建时间:
2025-01-17
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