Dataset

MYRCENE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP007563 contains the MS 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 C=CC(=C)CCC=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-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP007563
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
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
    31253 PubChem
    14916067 PubChem: Thomson Pharma
    123-35-3 ACToR
    3M39CZS25B FDA SRS
    MYRCENE clinicaltrials
    PD080528 ProbesDrugs
    526705 eMolecules
    10016287 NMRShiftDB
    SCHEMBL21622 SureChEMBL
    24584 Brenda
    17221 Rhea
    HMDB0038169 Human Metabolome Database
    CB0135735 ChemicalBook
    MTBLC17221 Metabolights
    6090 Brenda
    C06074 KEGG Ligand
    CHEMBL455491 ChEMBL
    17221 ChEBI
    MYRCENE rxnorm
    ZINC000001530331 ZINC
    LMPR0102010005 LipidMaps
    DTXSID6025692 EPA CompTox Dashboard
    J2.010I Nikkaji
    The data in this table is sourced from UniChem at EBI.