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

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

7-Chloranyl-4-phenyl-1,3-dihydro-1,5-benzodiazepin-2-one
SpectraBase Compound ID CiBiqRUso81
InChI InChI=1S/C15H11ClN2O/c16-11-6-7-12-14(8-11)17-13(9-15(19)18-12)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)
InChIKey MLSCGRASZVUJAC-UHFFFAOYSA-N
Mol Weight 270.72 g/mol
Molecular Formula C15H11ClN2O
Exact Mass 270.055991 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2hBdyzUwp7s
Name 7-Chloranyl-4-phenyl-1,3-dihydro-1,5-benzodiazepin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.055990681 u
Formula C15H11ClN2O
InChI InChI=1S/C15H11ClN2O/c16-11-6-7-12-14(8-11)17-13(9-15(19)18-12)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)
InChIKey MLSCGRASZVUJAC-UHFFFAOYSA-N
SMILES C1(NC=2C(N=C(C1)C=1C=CC=CC1)=CC(=CC2)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.88416