Dataset

Fumiquinazoline F; LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+

This MassBank record with Accession MSBNK-AAFC-AC000907 contains the MS2 mass spectrum of Fumiquinazoline F with the InChIkey SUVZUTHVKIBYOH-KPZWWZAWSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H18N4O2/c1-12-19-24-17-9-5-3-7-15(17)21(27)25(19)18(20(26)23-12)10-13-11-22-16-8-4-2-6-14(13)16/h2-9,11-12,18,22H,10H2,1H3,(H,23,26)/t12-,18+/m0/s1
SMILES C[C@H]1C2=NC3=CC=CC=C3C(=O)N2[C@@H](C(=O)N1)CC4=CNC5=CC=CC=C54
InChI Key SUVZUTHVKIBYOH-KPZWWZAWSA-N
Molecular Formula C21H18N4O2
Exact Mass 358.143 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-AC000907
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Maintainer
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MetadataPublished 2017-07-07
Related Molecule
  • (1S,4R)-4-(1H-indol-3-ylmethyl)-1-methyl-2,4-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:64550 chebi
    CHEMBL2229117 chembl
    31672855 surechembl
    10089772 pubchem
    The data in this table is sourced from UniChem at EBI.