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7-Acetamino-2,3-dihydro-5-phenyl-1H-1,4-benzodiazepin-2-one

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

7-Acetamino-2,3-dihydro-5-phenyl-1H-1,4-benzodiazepin-2-one
SpectraBase Compound ID 73DF5ewPgD
InChI InChI=1S/C17H15N3O2/c1-11(21)19-13-7-8-15-14(9-13)17(18-10-16(22)20-15)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,21)(H,20,22)
InChIKey JHTJXLGLYZQIGI-UHFFFAOYSA-N
Mol Weight 293.33 g/mol
Molecular Formula C17H15N3O2
Exact Mass 293.116427 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I3E15lCEErO
Name 7-Acetamino-2,3-dihydro-5-phenyl-1H-1,4-benzodiazepin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.116426733 u
Formula C17H15N3O2
InChI InChI=1S/C17H15N3O2/c1-11(21)19-13-7-8-15-14(9-13)17(18-10-16(22)20-15)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,21)(H,20,22)
InChIKey JHTJXLGLYZQIGI-UHFFFAOYSA-N
SMILES C12=C(C=CC(=C2)NC(=O)C)NC(CN=C1C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973853