Dataset

linoleamidoethyl formate[1]

This dataset contains NMR spectra obtained for the sample -linoleamidoethyl formate date: 2022-10-21T10:48:14.000Z isFt: false name: linoleamidoethyl formate/1 phc0: -127.1895 phc1: 33.78839 type: NMR FID DECIM: 1600 aqMod: 3 isFid: true tdOff: 0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 1H reverse: false solvent: CDCl3 dimension: 1 increment: 0.00003999999999999988 isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: null groupDelay: 67.9841461181641 temperature: 300.0004 spectrumSize: 131072 baseFrequency: 749.79 digitalFilter: 67.9841461181641 fieldStrength: 17.610014169485595 numberOfScans: 32 pulseSequence: MF1h spectralWidth: 16.6712532892125 numberOfPoints: 7 relaxationTime: 20 acquisitionTime: 0.00023999999999999927 frequencyOffset: 3658.7700000154655 originFrequency: 749.79365877 pulseStrength90: 37821.482602118 experimentNumber: 1 acquisitionScheme: undefined linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 4 date: 2022-10-21T11:52:41.000Z isFt: false name: linoleamidoethyl formate/2 phc0: -280.4065 phc1: 166.501 type: NMR FID DECIM: 480 aqMod: 3 isFid: true tdOff: 0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 13C reverse: false solvent: CDCl3 dimension: 1 increment: 0.000011999999999999975 isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: null groupDelay: 67.9835968017578 temperature: 299.9972 spectrumSize: 131072 baseFrequency: 188.534845 digitalFilter: 67.9835968017578 fieldStrength: 17.606262874685143 numberOfScans: 1024 pulseSequence: MFhetero1d spectralWidth: 220.98078751489 numberOfPoints: 39 relaxationTime: 2 acquisitionTime: 0.00045599999999999905 frequencyOffset: 18500.00000001728 originFrequency: 188.553345 pulseStrength90: 3125 experimentNumber: 2 acquisitionScheme: undefined linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2022-10-21T15:18:16.000Z isFt: false name: linoleamidoethyl formate/3 phc0: -280.4065 phc1: 166.501 type: NMR FID DECIM: 480 aqMod: 3 isFid: true tdOff: 0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 13C reverse: false solvent: CDCl3 dimension: 1 increment: 0.000011999999999999975 isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: null groupDelay: 67.9835968017578 temperature: 299.9997 spectrumSize: 131072 baseFrequency: 188.534845 digitalFilter: 67.9835968017578 fieldStrength: 17.606262874685143 numberOfScans: 3072 pulseSequence: MFhetero1d spectralWidth: 220.98078751489 numberOfPoints: 25 relaxationTime: 2 acquisitionTime: 0.0002879999999999994 frequencyOffset: 18500.00000001728 originFrequency: 188.553345 pulseStrength90: 3125 experimentNumber: 3 acquisitionScheme: undefined linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 0 date: 2022-10-21T15:18:56.000Z isFt: false name: linoleamidoethyl formate/4 phc0: 159.3838,-3.687547 phc1: -14.88921,0 type: NMR FID DECIM: 1600 aqMod: 3 isFid: true tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 1H,13C reverse: false,true solvent: CDCl3 dimension: 2 increment: 0.000039999999999999875 isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: hmqc groupDelay: 67.9841461181641 temperature: 300.0002 spectrumSize: 4096,2048 baseFrequency: 749.79,188.534845458 digitalFilter: 67.9841461181641 fieldStrength: 17.610014169485595 numberOfScans: 16 pulseSequence: MFhmqceaf2 spectralWidth: 16.6712532892125,165.738666738717 numberOfPoints: 2 relaxationTime: 1.3 acquisitionTime: 0.000039999999999999875 frequencyOffset: 3658.7700000154655,14999.999999986358 originFrequency: 749.79365877,188.549845458 pulseStrength90: 37821.482602118 experimentNumber: 4 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2022-10-21T18:26:18.000Z isFt: false name: linoleamidoethyl formate/5 phc0: 0,0 phc1: 0,0 type: NMR FID DECIM: 1600 aqMod: 3 isFid: true tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 1H,13C reverse: false,false solvent: CDCl3 dimension: 2 increment: 0.000039999999999999875 isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: hmbc groupDelay: 67.9841461181641 temperature: 300.002 spectrumSize: 4096,2048 baseFrequency: 749.79,188.534845458 digitalFilter: 67.9841461181641 fieldStrength: 17.610014169485595 numberOfScans: 64 pulseSequence: MFhmbceaf2 spectralWidth: 16.6712532892125,220.980806335721 numberOfPoints: 3 relaxationTime: 1.3 acquisitionTime: 0.00007999999999999975 frequencyOffset: 3658.7700000154655,18483.482999982924 originFrequency: 749.79365877,188.553328941 pulseStrength90: 37821.482602118 experimentNumber: 5 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 3,4 date: 2022-10-22T22:41:15.000Z isFt: false name: linoleamidoethyl formate/6 phc0: -114.1589,164.2559 phc1: -1.123564,28.8 type: NMR FID DECIM: 1600 aqMod: 3 isFid: true tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 1H,13C reverse: false,false solvent: CDCl3 dimension: 2 increment: null isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: hsqc groupDelay: 67.9841461181641 temperature: 300.0018 spectrumSize: 4096,2048 baseFrequency: 749.79,188.534845458 digitalFilter: 67.9841461181641 fieldStrength: 17.610014169485595 numberOfScans: 16 pulseSequence: MFhsqceaf2 spectralWidth: 16.6712532892125,176.786973573971 numberOfPoints: 1 relaxationTime: 1.3 acquisitionTime: 0 frequencyOffset: 3658.7700000154655,15999.999999991132 originFrequency: 749.79365877,188.550845458 pulseStrength90: 37821.482602118 experimentNumber: 6 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2022-10-23T11:15:05.000Z isFt: false name: linoleamidoethyl formate/7 phc0: -110.5239,92.07867 phc1: 2.022626,-180 type: NMR FID DECIM: 1600 aqMod: 3 isFid: true tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 1H,1H reverse: false,false solvent: CDCl3 dimension: 2 increment: null isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: cosy groupDelay: 67.9841461181641 temperature: 299.9995 spectrumSize: 4096,2048 baseFrequency: 749.79,749.79 digitalFilter: 67.9841461181641 fieldStrength: 17.610014169485595 numberOfScans: 8 pulseSequence: MFclipcosy spectralWidth: 16.6712532892125,13.33700263137 numberOfPoints: 1 relaxationTime: 1.3 acquisitionTime: 0 frequencyOffset: 3658.7700000154655,3658.7700000154655 originFrequency: 749.79365877,749.79365877 pulseStrength90: 33025.09907529722 experimentNumber: 7 acquisitionScheme: States-TPPI linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2022-10-23T14:49:29.000Z isFt: false name: linoleamidoethyl formate/8 phc0: 72.23617,137.225 phc1: -1.785551,-180 type: NMR FID DECIM: 1600 aqMod: 3 isFid: true tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 1H,1H reverse: false,false solvent: CDCl3 dimension: 2 increment: null isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: tocsy groupDelay: 67.9841461181641 temperature: 299.9999 spectrumSize: 4096,2048 baseFrequency: 749.79,749.79 digitalFilter: 67.9841461181641 fieldStrength: 17.610014169485595 numberOfScans: 8 pulseSequence: MFdipsi2 spectralWidth: 16.6712532892125,13.33700263137 numberOfPoints: 1 relaxationTime: 1.3 acquisitionTime: 0 frequencyOffset: 3658.7700000154655,3658.7700000154655 originFrequency: 749.79365877,749.79365877 pulseStrength90: 33025.09907529722 experimentNumber: 8 acquisitionScheme: States-TPPI linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2022-10-23T18:32:03.000Z isFt: false name: linoleamidoethyl formate/9 phc0: -44.38342,-177.7467 phc1: 13.41118,0 type: NMR FID DECIM: 1600 aqMod: 3 isFid: true tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 6 DSPFVS: 20 nucleus: 1H,13C reverse: false,false solvent: CDCl3 dimension: 2 increment: null isComplex: true probeName: Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) experiment: hsqc groupDelay: 67.9841461181641 temperature: 300 spectrumSize: 4096,2048 baseFrequency: 749.79,188.534845458 digitalFilter: 67.9841461181641 fieldStrength: 17.610014169485595 numberOfScans: 16 pulseSequence: MFhsqceaclipcosyf2 spectralWidth: 16.6712532892125,176.786973573971 numberOfPoints: 1 relaxationTime: 1.3 acquisitionTime: 0 frequencyOffset: 3658.7700000154655,15999.999999991132 originFrequency: 749.79365877,188.550845458 pulseStrength90: 37821.482602118 experimentNumber: 9 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4

Chemical Information

molecular Image
InChI InChI=1S/C21H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)22-18-19-25-20-23/h6-7,9-10,20H,2-5,8,11-19H2,1H3,(H,22,24)/b7-6-,10-9-
SMILES CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCCOC=O
InChI Key VTPIYOLAFDQBFJ-HZJYTTRNSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p118.s1229.d5263
License URL
Source https://nmrxiv.org/D5263
Version
Author
Maintainer
Language english
MetadataPublished 2026-01-01T10:37:00.000000Z
Related Molecule
  • nfdi4chem-mol5324 (Unknown Molecule)
    • Field Value
    Measurement Technique
    Measurement Variables
    NMR solvent : CDCl3

    acquisition nucleus : ['1H']

    NMR spectrum by dimensionality : 1

    NMR probe : Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z)

    Temperature : 300.0004 K

    magnetic field strength : 17.610014169485595 Tesla

    number of scans : 32 scans

    nuclear magnetic resonance pulse sequence : MF1h

    Spectral Width : 16.6712532892125

    number of data points : 7 points

    relaxation time measurement : 20 seconds

    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.