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2-Acetyl-4-phenyl-1,4-dihydro-1H-1,3,4-benzotriazepin-5-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-Acetyl-4-phenyl-1,4-dihydro-1H-1,3,4-benzotriazepin-5-one
SpectraBase Compound ID DBpP3g3dtll
InChI InChI=1S/C16H13N3O2/c1-11(20)15-17-14-10-6-5-9-13(14)16(21)19(18-15)12-7-3-2-4-8-12/h2-10H,1H3,(H,17,18)
InChIKey HVCYQRRNOFLPCP-UHFFFAOYSA-N
Mol Weight 279.3 g/mol
Molecular Formula C16H13N3O2
Exact Mass 279.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJkpH4oBvJB
Name 2-Acetyl-4-phenyl-3H-1,3,4-benzotriazepin-5-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3O2
InChI InChI=1S/C16H13N3O2/c1-11(20)15-17-14-10-6-5-9-13(14)16(21)19(18-15)12-7-3-2-4-8-12/h2-10H,1H3,(H,17,18)
InChIKey HVCYQRRNOFLPCP-UHFFFAOYSA-N
Molecular Weight 279.299 g/mol
SMILES N1c2c(C(N(N=C1C(=O)C)c1ccccc1)=O)cccc2
SPLASH splash10-003r-0690000000-e6b57f1415b533430985
Source of Spectrum Y-39-903-7
Synonyms 2-Ethanoyl-4-phenyl-3H-1,3,4-benzotriazepin-5-one
Wiley ID 1528568