Dataset

6,7-EPOXYOCTADECANOIC ACID METHYL ESTER; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP005364 contains the MS mass spectrum of 6,7-EPOXYOCTADECANOIC ACID METHYL ESTER with the InChIkey XZBRNQGAEDOQPT-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H36O3/c1-3-4-5-6-7-8-9-10-11-14-17-18(22-17)15-12-13-16-19(20)21-2/h17-18H,3-16H2,1-2H3
SMILES CCCCCCCCCCCC(O1)C(CCCCC(=O)OC)1
InChI Key XZBRNQGAEDOQPT-UHFFFAOYSA-N
Molecular Formula C19H36O3
Exact Mass 312.266 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-JP005364
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • methyl 5-(3-undecyloxiran-2-yl)pentanoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    11085114 surechembl
    537043 pubchem
    DTXSID801346998 comptox
    The data in this table is sourced from UniChem at EBI.