Dataset

10b_Varian[10b_HEE311_20140219_08.1H.fid]

This dataset contains NMR spectra obtained for the sample -10b_Varian name: 10b_HEE311_20140219_08.13C.fid phc0: 48.601234436 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776222 spectralWidth: 248.67511810072892 numberOfPoints: 32768 frequencyOffset: 11058.87800000005 originFrequency: 100.5438351 name: 10b_HEE311_20140219_08.1H.fid phc0: -76.1750584233 isFid: true nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 399.811874262 spectralWidth: 17.968220826959048 numberOfPoints: 16384 frequencyOffset: 2801.637999994 originFrequency: 399.8146759 name: 10b_HEE311_20140219_08.dept.fid phc0: -46.9 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776222 spectralWidth: 248.67511810072892 numberOfPoints: 32768 frequencyOffset: 11058.87800000005 originFrequency: 100.5438351

Chemical Information

molecular Image
InChI InChI=1S/C15H26O3/c1-2-3-4-5-6-7-8-9-10-14-13(16)11-12-15(17)18-14/h11-12,14-15,17H,2-10H2,1H3/t14-,15?/m1/s1
SMILES CCCCCCCCCC[C@H]1OC(O)C=CC1=O
InChI Key ZWUNUXNXAVPNGF-GICMACPYSA-N
Molecular Formula C15H26O3
Exact Mass 254.360 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p57.s329.d1850
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1850
Version
Author Toni Ditfe, Eileen Bette, Haider N. Sultani, Alexander Otto, Ludger A. Wessjohann, Norbert Arnold, Bernhard Westermann
Maintainer
Language english
MetadataPublished 2024-01-19T09:20:10.000000Z
Related Molecule
  • (6R)-6-decyl-2-hydroxy-2H-pyran-5-one
    • Field Value
    Measurement Technique
    Measurement Variables
    NMR solvent : cdcl3

    acquisition nucleus : ['1H']

    NMR spectrum by dimensionality : 1

    NMR probe :

    Temperature : 25 K

    magnetic field strength : Tesla

    number of scans : scans

    nuclear magnetic resonance pulse sequence :

    Spectral Width : 17.968220826959048

    number of data points : 16384 points

    relaxation time measurement : seconds

    Data-Source Molecule ID Data-Source
    14641216 PubChem
    The data in this table is sourced from UniChem at EBI.