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N-[2-(3-Bromophenyl)ethyl]-4-methoxybenzamide

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

N-[2-(3-Bromophenyl)ethyl]-4-methoxybenzamide
SpectraBase Compound ID EQbW1TKC3ZX
InChI InChI=1S/C16H16BrNO2/c1-20-15-7-5-13(6-8-15)16(19)18-10-9-12-3-2-4-14(17)11-12/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKey KSKQHGSYLJATDG-UHFFFAOYSA-N
Mol Weight 334.21 g/mol
Molecular Formula C16H16BrNO2
Exact Mass 333.036442 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AICH1XRKzCe
Name N-[2-(3-Bromophenyl)ethyl]-4-methoxybenzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.036441757 u
Formula C16H16BrNO2
InChI InChI=1S/C16H16BrNO2/c1-20-15-7-5-13(6-8-15)16(19)18-10-9-12-3-2-4-14(17)11-12/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKey KSKQHGSYLJATDG-UHFFFAOYSA-N
Molecular Weight 334.213 g/mol
SMILES C=1(C(NCCC=2C=C(C=CC2)Br)=O)C=CC(=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.830716