For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-(4-Bromophenyl)-1-(4-methoxyphenyl)-1-butanone

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

2-(4-Bromophenyl)-1-(4-methoxyphenyl)-1-butanone
SpectraBase Compound ID ssofcpEbpF
InChI InChI=1S/C17H17BrO2/c1-3-16(12-4-8-14(18)9-5-12)17(19)13-6-10-15(20-2)11-7-13/h4-11,16H,3H2,1-2H3
InChIKey BFVYZIPGKMAEJB-UHFFFAOYSA-N
Mol Weight 333.23 g/mol
Molecular Formula C17H17BrO2
Exact Mass 332.041193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JRmI5kUAQrb
Name 2-(4-Bromophenyl)-1-(4-methoxyphenyl)-1-butanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.041192785 u
Formula C17H17BrO2
InChI InChI=1S/C17H17BrO2/c1-3-16(12-4-8-14(18)9-5-12)17(19)13-6-10-15(20-2)11-7-13/h4-11,16H,3H2,1-2H3
InChIKey BFVYZIPGKMAEJB-UHFFFAOYSA-N
Molecular Weight 333.225 g/mol
SMILES C(C(C=1C=CC(=CC1)Br)CC)(C1=CC=C(C=C1)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913699