Dataset

Dihydrojasmone; LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV

This MassBank record with Accession MSBNK-Fiocruz-FIO00049 contains the MS2 mass spectrum of Dihydrojasmone with the InChIkey YCIXWYOBMVNGTB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H18O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h3-8H2,1-2H3
SMILES CCCCCC(=C(C)1)C(=O)CC1
InChI Key YCIXWYOBMVNGTB-UHFFFAOYSA-N
Molecular Formula C11H18O
Exact Mass 166.136 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00049
Version
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 3-methyl-2-pentylcyclopent-2-en-1-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:143730 chebi
    CHEMBL3728427 chembl
    114204 surechembl
    62378 pubchem
    PD088153 probes_and_drugs
    Y953R7PP90 fdasrs
    HMDB0031565 hmdb
    Molport-003-925-033 molport
    The data in this table is sourced from UniChem at EBI.