Dataset

Glucuronic acid; LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00991 contains the MS2 mass spectrum of Glucuronic acid with the InChIkey AEMOLEFTQBMNLQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)
SMILES C1(C(C(OC(C1O)O)C(=O)O)O)O
InChI Key AEMOLEFTQBMNLQ-UHFFFAOYSA-N
Molecular Formula C6H10O7
Exact Mass 194.043 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00991
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 3,4,5,6-tetrahydroxyoxane-2-carboxylic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:229940 chebi
    2519396 surechembl
    610 pubchem
    PD041261 probes_and_drugs
    DINXUT CCDC
    98282 brenda
    HMDB0247881 hmdb
    Molport-001-785-887 molport
    Molport-046-682-038 molport
    The data in this table is sourced from UniChem at EBI.