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2-ACETYL-4-(4-METHYLPHENYL)-1,4-DIHYDRO-1H-1,3,4-BENZOTRIAZEPIN-5-ONE
SpectraBase Compound ID 8mBGjWRo2jX
InChI InChI=1S/C17H15N3O2/c1-11-7-9-13(10-8-11)20-17(22)14-5-3-4-6-15(14)18-16(19-20)12(2)21/h3-10H,1-2H3,(H,18,19)
InChIKey SKGGJUSVMUMPAB-UHFFFAOYSA-N
Mol Weight 293.33 g/mol
Molecular Formula C17H15N3O2
Exact Mass 293.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FocBTEP583o
Name 2-Acetyl-4-(4-methylphenyl)-3H-1,3,4-benzotriazepin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N3O2
InChI InChI=1S/C17H15N3O2/c1-11-7-9-13(10-8-11)20-17(22)14-5-3-4-6-15(14)18-16(19-20)12(2)21/h3-10H,1-2H3,(H,18,19)
InChIKey SKGGJUSVMUMPAB-UHFFFAOYSA-N
Molecular Weight 293.326 g/mol
SMILES N1c2c(C(N(N=C1C(=O)C)c1ccc(cc1)C)=O)cccc2
SPLASH splash10-0007-4930000000-184e50afbaaaa6b93e30
Source of Spectrum Y-39-903-7
Synonyms 2-Acetyl-4-(p-tolyl)-3H-1,3,4-benzotriazepin-5-one 2-Ethanoyl-4-(4-methylphenyl)-3H-1,3,4-benzotriazepin-5-one
Wiley ID 1528567