Dataset

5c_JCAMP[5c_HEE152.jdx]

Chemical Information

molecular Image
InChI InChI=1S/C17H30O2/c1-2-3-4-5-6-7-8-9-10-11-13-16(18)17-14-12-15-19-17/h12,14-16,18H,2-11,13H2,1H3
SMILES CCCCCCCCCCCCC(O)C1=CC=CO1
InChI Key KWSOXPPLWZODNZ-UHFFFAOYSA-N
Molecular Formula C17H30O2
Exact Mass 266.400 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p57.s344.d1876
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1876
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
  • 1-(furan-2-yl)tridecan-1-ol
    • Field Value
    Measurement Technique
    Measurement Variables
    NMR solvent : cdcl3

    acquisition nucleus : ['13C']

    NMR spectrum by dimensionality : 1

    NMR probe :

    Temperature : K

    magnetic field strength : Tesla

    number of scans : scans

    nuclear magnetic resonance pulse sequence : s2pul

    Spectral Width :

    number of data points : 65536 points

    relaxation time measurement : seconds

    Data-Source Molecule ID Data-Source
    103910024 PubChem: Thomson Pharma
    15721351 PubChem
    J718.949D Nikkaji
    The data in this table is sourced from UniChem at EBI.