Dataset

Glycolic acid; LC-ESI-QQ; MS2; CE:20 V; [M-H]-

This MassBank record with Accession MSBNK-Keio_Univ-KO000833 contains the MS2 mass spectrum of Glycolic acid with the InChIkey AEMRFAOFKBGASW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5)
SMILES OCC(O)=O
InChI Key AEMRFAOFKBGASW-UHFFFAOYSA-N
Molecular Formula C2H4O3
Exact Mass 76.016 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-Keio_Univ-KO000833
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MetadataPublished 2016-01-19
Related Molecule
  • 2-hydroxyacetic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB03085 drugbank
    CHEBI:17497 chebi
    GOA rcsb_pdb
    CHEMBL252557 chembl
    1222 surechembl
    3698251 pubchem
    757 pubchem
    0WT12SX38S fdasrs
    PD007399 probes_and_drugs
    GLICAC CCDC
    207315 brenda
    31683 brenda
    31684 brenda
    4251 brenda
    479 brenda
    HMDB0000115 hmdb
    Molport-000-871-981 molport
    4645 drugcentral
    The data in this table is sourced from UniChem at EBI.