Dataset

6b.1d

This dataset contains NMR spectra obtained for the sample -6b date: 2021-01-07T23:25:53.000Z isFt: false name: 6b/3 phc0: 0 phc1: 0 type: NMR FID DECIM: 2000 aqMod: 3 isFid: true tdOff: 0 title: Parameter file, TopSpin 3.6.2 DSPFVS: 20 nucleus: 1H reverse: false solvent: CDCl3 dimension: 1 increment: null isComplex: true probeName: Z149001_0004 (CPP BBO 500S1 BB-H&F-05 Z) experiment: 1d groupDelay: 67.9862518310547 temperature: 298.15 spectrumSize: 65536 baseFrequency: 500.13 digitalFilter: 67.9862518310547 fieldStrength: 11.746350827011339 numberOfScans: 8 pulseSequence: zg30 spectralWidth: 19.9946778845251 numberOfPoints: 1 relaxationTime: 1 acquisitionTime: 0 frequencyOffset: 3088.3019999805583 originFrequency: 500.133088302 pulseStrength90: 23255.81395348837 experimentNumber: 3 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1

Chemical Information

molecular Image
InChI InChI=1S/C27H46O3Si/c1-25(2,3)31(7,8)30-20-13-14-26(4)18(15-20)9-11-21-22-12-10-19(17-29-6)27(22,5)24(28)16-23(21)26/h9,17,20-24,28H,10-16H2,1-8H3/b19-17+
SMILES CO/C=C1\CCC2C3CC=C4CC(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CC(O)C12C
InChI Key GSRQUTXOHOLLHT-HTXNQAPBSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p69.s528.d2766
License URL https://creativecommons.org/licenses/by-nc-sa/4.0/legalcode
Source https://nmrxiv.org/D2766
Version
Author
Maintainer
Language english
MetadataPublished 2024-06-05 22:00:45
Related Molecule
  • nfdi4chem-mol1956 (Unknown Molecule)
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    NMR solvent : CDCl3

    acquisition nucleus : 1H

    NMR spectrum by dimensionality : 1

    NMR probe : Z149001_0004 (CPP BBO 500S1 BB-H&F-05 Z)

    Temperature : 298.15 K

    magnetic field strength : 11.746350827011339 Tesla

    number of scans : 8 scans

    nuclear magnetic resonance pulse sequence : zg30

    Spectral Width : 19.9946778845251

    number of data points : 1 points

    relaxation time measurement : 1 seconds

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