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3-Pheny1-5-acetyl-10,ll-dihydro-5H-dibenz[b,f]azepin

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

3-Pheny1-5-acetyl-10,ll-dihydro-5H-dibenz[b,f]azepin
SpectraBase Compound ID 2cWd4aa65Wh
InChI InChI=1S/C22H19NO/c1-16(24)23-21-10-6-5-9-18(21)11-12-19-13-14-20(15-22(19)23)17-7-3-2-4-8-17/h2-10,13-15H,11-12H2,1H3
InChIKey PIBUBVJTDNEOAE-UHFFFAOYSA-N
Mol Weight 313.4 g/mol
Molecular Formula C22H19NO
Exact Mass 313.146664 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LodReTny5bo
Name 3-Pheny1-5-acetyl-10,ll-dihydro-5H-dibenz[B,F]azepin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.146664235 u
Formula C22H19NO
InChI InChI=1S/C22H19NO/c1-16(24)23-21-10-6-5-9-18(21)11-12-19-13-14-20(15-22(19)23)17-7-3-2-4-8-17/h2-10,13-15H,11-12H2,1H3
InChIKey PIBUBVJTDNEOAE-UHFFFAOYSA-N
Molecular Weight 313.400 g/mol
SMILES C1CC2=CC=C(C=C2N(C2=CC=CC=C12)C(=O)C)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902801