Dataset

Viridicatol; LC-ESI-ITFT; MS2; CE: 40; R=17500; [M+H]+

This MassBank record with Accession MSBNK-AAFC-AC000850 contains the MS2 mass spectrum of Viridicatol with the InChIkey QIJIOTTYIGBOQA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H11NO3/c17-10-5-3-4-9(8-10)13-11-6-1-2-7-12(11)16-15(19)14(13)18/h1-8,17-18H,(H,16,19)
SMILES C1=CC=C2C(=C1)C(=C(C(=O)N2)O)C3=CC(=CC=C3)O
InChI Key QIJIOTTYIGBOQA-UHFFFAOYSA-N
Molecular Formula C15H11NO3
Exact Mass 253.074 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-AAFC-AC000850
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MetadataPublished 2017-07-07
Related Molecule
  • 3-hydroxy-4-(3-hydroxyphenyl)-1H-quinolin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:201598 chebi
    115033 pubchem
    45P12JNE0L fdasrs
    PD077957 probes_and_drugs
    EVOLUX CCDC
    77144 brenda
    Molport-001-739-281 molport
    The data in this table is sourced from UniChem at EBI.