Dataset

5-OXOCAPROIC ACID METHYU ESTER; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004235 contains the MS mass spectrum of 5-OXOCAPROIC ACID METHYU ESTER with the InChIkey AVVPOKSKJSJVIX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C7H12O3/c1-6(8)4-3-5-7(9)10-2/h3-5H2,1-2H3
SMILES COC(=O)CCCC(C)=O
InChI Key AVVPOKSKJSJVIX-UHFFFAOYSA-N
Molecular Formula C7H12O3
Exact Mass 144.079 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-JP004235
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Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • methyl 5-oxohexanoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.