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N-Benzyl-3-bromoaniline, N-acetyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

N-Benzyl-3-bromoaniline, N-acetyl-
SpectraBase Compound ID 4GtWUhZwnjI
InChI InChI=1S/C15H14BrNO/c1-12(18)17(11-13-6-3-2-4-7-13)15-9-5-8-14(16)10-15/h2-10H,11H2,1H3
InChIKey IWOFQVUBSVWMFL-UHFFFAOYSA-N
Mol Weight 304.19 g/mol
Molecular Formula C15H14BrNO
Exact Mass 303.025877 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DpROIuCRbhW
Name N-Benzyl-3-bromoaniline, N-acetyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.025877074 u
Formula C15H14BrNO
InChI InChI=1S/C15H14BrNO/c1-12(18)17(11-13-6-3-2-4-7-13)15-9-5-8-14(16)10-15/h2-10H,11H2,1H3
InChIKey IWOFQVUBSVWMFL-UHFFFAOYSA-N
Molecular Weight 304.187 g/mol
SMILES C1(Br)=CC(=CC=C1)N(CC1=CC=CC=C1)C(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.833011