Dataset

linoleamidoethyl formate[4]

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

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

linoleamidoethyl formate[4]HTML

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Metadata Information

Field	Value
DOI	10.57992/nmrxiv.p118.s1229.d5266
License URL
Source	https://nmrxiv.org/D5266
Version
Author
Maintainer
Language	english
MetadataPublished	2026-01-01T10:37:00.000000Z
Related Molecule

Field	Value
Measurement Technique	heteronuclear multiple quantum coherence
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : ['1H', '13C'] NMR spectrum by dimensionality : 2 NMR probe : Z44915_0001 (CP TCI 750S7 H-C/N-D-05 Z) Temperature : 300.0002 K magnetic field strength : 17.610014169485595 Tesla number of scans : 16 scans nuclear magnetic resonance pulse sequence : MFhmqceaf2 Spectral Width : [16.6712532892125, 165.738666738717] number of data points : 2 points relaxation time measurement : 1.3 seconds

Data-Source Molecule ID	Data-Source
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