Dataset

GAMMA-NONALACTONE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008729 contains the MS mass spectrum of GAMMA-NONALACTONE with the InChIkey OALYTRUKMRCXNH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H16O2/c1-2-3-4-5-8-6-7-9(10)11-8/h8H,2-7H2,1H3
SMILES CCCCCC(C1)OC(=O)C1
InChI Key OALYTRUKMRCXNH-UHFFFAOYSA-N
Molecular Formula C9H16O2
Exact Mass 156.115 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-JP008729
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 5-pentyloxolan-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    GAMMA-NONALACTONE rxnorm
    LMFA07040021 LipidMaps
    DTXSID0034229 EPA CompTox Dashboard
    I1XGH66S8P FDA SRS
    J2.412K Nikkaji
    50167995 BindingDB
    CHEMBL191935 ChEMBL
    495350 eMolecules
    7710 PubChem
    104-61-0 ACToR
    15194814 PubChem: Thomson Pharma
    SCHEMBL112484 SureChEMBL
    57084-16-9 ACToR
    CB8157049 ChemicalBook
    197674 Brenda
    HMDB0031531 Human Metabolome Database
    148308 Brenda
    8971 Brenda
    3413 Brenda
    35887 Brenda
    MCULE-8658118167 Mcule
    20200137 NMRShiftDB
    The data in this table is sourced from UniChem at EBI.