Dataset

Myrcene; APCI-ITFT; MS2; CE: 35 CID; [M+H]+

This MassBank record with Accession MSBNK-mFam-MC01_000064 contains the MS2 mass spectrum of Myrcene with the InChIkey UAHWPYUMFXYFJY-UHFFFAOYSA-N.

Chemical Information

Molecular Image
InChI InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3
SMILES CC(=CCCC(=C)C=C)C
InChI Key UAHWPYUMFXYFJY-UHFFFAOYSA-N
Molecular Formula C10H16
Exact Mass 136.125 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-mFam-MC01_000064
Version
Author
Maintainer
Language
MetadataPublished 2023-01-17
Related Molecule
  • 7-methyl-3-methylideneocta-1,6-diene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:17221 chebi
    LMPR0102010005 lipidmaps
    CHEMBL455491 chembl
    21622 surechembl
    31253 pubchem
    3M39CZS25B fdasrs
    PD080528 probes_and_drugs
    24584 brenda
    6090 brenda
    HMDB0038169 hmdb
    DTXSID6025692 comptox
    NCT04451863 clinicaltrials
    NCT05432284 clinicaltrials
    FDB017400 foodb
    Molport-001-792-515 molport
    The data in this table is sourced from UniChem at EBI.