4c
收藏DataCite Commons2025-04-08 更新2025-04-16 收录
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This dataset contains NMR spectra obtained for the sample -4c date: 2021-07-27T13:49:00.000Z isFt: true name: 4c/0 phc0: -256.1277 phc1: 26.22926 type: NMR Spectrum DECIM: 4 aqMod: 1 isFid: false tdOff: 0 title: Parameter file, TOPSPIN Version 2.1 DSPFVS: 10 nucleus: 13C reverse: false solvent: CDCl3 dimension: 1 increment: 33.46457959319722 isComplex: true probeName: 5 mm PABBO BB-1H/D Z-GRD Z114261/0041 experiment: 1d groupDelay: -1 temperature: 295 spectrumSize: 32768 baseFrequency: 150.902809 fieldStrength: 14.092007892665164 numberOfScans: 1024 pulseSequence: zgpg30 spectralWidth: 301.181216338775 numberOfPoints: 10 relaxationTime: 2 acquisitionTime: 0.00009899999999999997 frequencyOffset: 18108.33708000814 originFrequency: 150.92091733708 pulseStrength90: 22321.428571428572 experimentNumber: 0 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2023-09-15T10:50:21.000Z isFt: true name: 4c/0 phc0: 154.3844 phc1: 0 type: NMR Spectrum DECIM: 224 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TOPSPIN Version 3.0 DSPFVS: 20 nucleus: 19F reverse: false solvent: CDCl3 dimension: 1 increment: 29.646424730462623 isComplex: true probeName: 5 mm PABBO BB-1H/D Z-GRD Z108618/0120 experiment: 1d groupDelay: 67.9827117919922 temperature: 296.5044 spectrumSize: 65536 baseFrequency: 376.498366 fieldStrength: 9.399945170221654 numberOfScans: 128 pulseSequence: zgfhigqn.2 spectralWidth: 237.171397843701 numberOfPoints: 9 relaxationTime: 1 acquisitionTime: 0.00004479999999999998 frequencyOffset: -37649.83659999643 originFrequency: 376.4607161634 pulseStrength90: 21739.130434782608 experimentNumber: 0 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2021-07-27T13:00:08.000Z isFt: true name: 4c/0 phc0: -205.8549 phc1: 17.70076 type: NMR Spectrum DECIM: 16 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TOPSPIN Version 2.1 DSPFVS: 12 nucleus: 1H reverse: false solvent: CDCl3 dimension: 1 increment: 2.291385236143422 isComplex: true probeName: 5 mm PABBO BB-1H/D Z-GRD Z114261/0041 experiment: 1d groupDelay: -1 temperature: 295 spectrumSize: 32768 baseFrequency: 600.13 fieldStrength: 14.095010340939984 numberOfScans: 32 pulseSequence: zg30 spectralWidth: 20.6224671252908 numberOfPoints: 10 relaxationTime: 1 acquisitionTime: 0.00036360000000000076 frequencyOffset: 3706.0484139601613 originFrequency: 600.133706048414 pulseStrength90: 17857.14285714286 experimentNumber: 0 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1
本数据集包含获取自样品-4c的核磁共振波谱(NMR Spectrum),各谱图的详细参数如下:
1. 采集日期:2021-07-27T13:49:00.000Z,是否经傅里叶变换:是,样本名称:4c/0,相位校正参数0:-256.1277,相位校正参数1:26.22926,谱图类型:核磁共振波谱,抽取因子:4,采集模式:1,是否为自由感应衰减时域信号:否,时域偏移:0,参数文件信息:TOPSPIN 版本2.1,DSPFVS:10,观测核:13C,是否反转:否,溶剂:氘代氯仿(CDCl3),维度:1维,采样增量:33.46457959319722,是否为复数据:是,探头名称:5 mm PABBO BB-1H/D Z-GRD Z114261/0041,实验类型:1d,组延迟:-1,温度:295,谱图尺寸:32768,基频:150.902809,场强:14.092007892665164,扫描次数:1024,脉冲序列:zgpg30,谱宽:301.181216338775,点数:10,弛豫时间:2,采集时间:0.00009899999999999997,频率偏移:18108.33708000814,固有频率:150.92091733708,90度脉冲强度:22321.428571428572,实验编号:0,线性预测bin:0,线性预测系数数目:0,窗函数乘法模式:1
2. 采集日期:2023-09-15T10:50:21.000Z,是否经傅里叶变换:是,样本名称:4c/0,相位校正参数0:154.3844,相位校正参数1:0,谱图类型:核磁共振波谱,抽取因子:224,采集模式:3,是否为自由感应衰减时域信号:否,时域偏移:0,参数文件信息:TOPSPIN 版本3.0,DSPFVS:20,观测核:19F,是否反转:否,溶剂:氘代氯仿(CDCl3),维度:1维,采样增量:29.646424730462623,是否为复数据:是,探头名称:5 mm PABBO BB-1H/D Z-GRD Z108618/0120,实验类型:1d,组延迟:67.9827117919922,温度:296.5044,谱图尺寸:65536,基频:376.498366,场强:9.399945170221654,扫描次数:128,脉冲序列:zgfhigqn.2,谱宽:237.171397843701,点数:9,弛豫时间:1,采集时间:0.00004479999999999998,频率偏移:-37649.83659999643,固有频率:376.4607161634,90度脉冲强度:21739.130434782608,实验编号:0,线性预测bin:0,线性预测系数数目:0,窗函数乘法模式:1
3. 采集日期:2021-07-27T13:00:08.000Z,是否经傅里叶变换:是,样本名称:4c/0,相位校正参数0:-205.8549,相位校正参数1:17.70076,谱图类型:核磁共振波谱,抽取因子:16,采集模式:3,是否为自由感应衰减时域信号:否,时域偏移:0,参数文件信息:TOPSPIN 版本2.1,DSPFVS:12,观测核:1H,是否反转:否,溶剂:氘代氯仿(CDCl3),维度:1维,采样增量:2.291385236143422,是否为复数据:是,探头名称:5 mm PABBO BB-1H/D Z-GRD Z114261/0041,实验类型:1d,组延迟:-1,温度:295,谱图尺寸:32768,基频:600.13,场强:14.095010340939984,扫描次数:32,脉冲序列:zg30,谱宽:20.6224671252908,点数:10,弛豫时间:1,采集时间:0.00036360000000000076,频率偏移:3706.0484139601613,固有频率:600.133706048414,90度脉冲强度:17857.14285714286,实验编号:0,线性预测bin:0,线性预测系数数目:0,窗函数乘法模式:1
提供机构:
nmrXiv
创建时间:
2025-04-08



