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4-(2H-benzo[d][1,2,3]triazol-2-yl)isochroman-3-one
SpectraBase Compound ID E4TXOaU3rds
InChI InChI=1S/C15H11N3O2/c19-15-14(11-6-2-1-5-10(11)9-20-15)18-16-12-7-3-4-8-13(12)17-18/h1-8,14H,9H2
InChIKey BYGBWJWESAZEQO-UHFFFAOYSA-N
Mol Weight 265.27 g/mol
Molecular Formula C15H11N3O2
Exact Mass 265.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EhwjIOadto
Name 4-(2H-benzo[d][1,2,3]triazol-2-yl)isochroman-3-one
Appearance Yellow oil
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Exact Mass 265.085126604 u
Formula C15H11N3O2
InChI InChI=1S/C15H11N3O2/c19-15-14(11-6-2-1-5-10(11)9-20-15)18-16-12-7-3-4-8-13(12)17-18/h1-8,14H,9H2
InChIKey BYGBWJWESAZEQO-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201807039
Molecular Weight 265.272 g/mol
Quality 672
Reported Formula C15H11N3O2
SMILES C1=CC=CC2=NN(N=C12)C1C(OCC2=C1C=CC=C2)=O
SPLASH splash10-0002-3960000000-eb6366fe5ade6d27cb72
Source of Spectrum ACI-57-SM162-3k (DOI: 10.1002/anie.201807039)
Wiley ID 1896823