Dataset

Valsartanic acid; LC-ESI-QTOF; MS2; 70 V

This MassBank record with Accession MSBNK-BAFG-CSL2311093689 contains the MS2 mass spectrum of Valsartanic acid with the InChIkey USAWIVMZUYOXCF-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H10N4O2/c19-14(20)10-7-5-9(6-8-10)11-3-1-2-4-12(11)13-15-17-18-16-13/h1-8H,(H,19,20)(H,15,16,17,18)
SMILES O=C(O)C(C=C1)=CC=C1C2=CC=CC=C2C3=NN=NN3
InChI Key USAWIVMZUYOXCF-UHFFFAOYSA-N
Molecular Formula C14H10N4O2
Exact Mass 266.080 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311093689
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MetadataPublished 2023-11-09
Related Molecule
  • 4-[2-(2H-tetrazol-5-yl)phenyl]benzoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    19388302 PubChem
    167832 ChEBI
    DTXSID20881090 EPA CompTox Dashboard
    J3.227.680F Nikkaji
    PD164115 ProbesDrugs
    SCHEMBL5485083 SureChEMBL
    The data in this table is sourced from UniChem at EBI.