Dataset

DIMETHYL SUCCINATE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP006034 contains the MS mass spectrum of DIMETHYL SUCCINATE with the InChIkey MUXOBHXGJLMRAB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H10O4/c1-9-5(7)3-4-6(8)10-2/h3-4H2,1-2H3
SMILES COC(=O)CCC(=O)OC
InChI Key MUXOBHXGJLMRAB-UHFFFAOYSA-N
Molecular Formula C6H10O4
Exact Mass 146.058 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-JP006034
Version
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • dimethyl butanedioate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:165393 chebi
    9HB rcsb_pdb
    CHEMBL556489 chembl
    10213 surechembl
    7820 pubchem
    914I2127JR fdasrs
    PD220827 probes_and_drugs
    VEBYEG CCDC
    15847 brenda
    16569 brenda
    166888 brenda
    9HB - Ideal conformer pdbe
    HMDB0033837 hmdb
    Molport-000-872-096 molport
    The data in this table is sourced from UniChem at EBI.