Dataset

Citric acid; GC-EI-Q; MS; POSITIVE; 4TBDMS-derivative

This MassBank record with Accession MSBNK-MSSJ-MSJ00700 contains the MS mass spectrum of Citric acid with the InChIkey KRKNYBCHXYNGOX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
SMILES OC(=O)CC(O)(CC(O)=O)C(=O)O
InChI Key KRKNYBCHXYNGOX-UHFFFAOYSA-N
Molecular Formula C6H8O7
Exact Mass 192.027 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-MSSJ-MSJ00700
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MetadataPublished 2021-09-06
Related Molecule
  • 2-hydroxypropane-1,2,3-tricarboxylic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.