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

*Links on SpectraBase are not permalinks.

(5R,1E)-5-Hydroxy-5-(2-bromophenyl)-1-phenyl-1-penten-3-one

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

(5R,1E)-5-Hydroxy-5-(2-bromophenyl)-1-phenyl-1-penten-3-one
SpectraBase Compound ID Daw4itxry8v
InChI InChI=1S/C17H15BrO2/c18-16-9-5-4-8-15(16)17(20)12-14(19)11-10-13-6-2-1-3-7-13/h1-11,17,20H,12H2/b11-10+/t17-/m1/s1
InChIKey CFDXSXSSMCNNKK-SXSDINLZSA-N
Mol Weight 331.21 g/mol
Molecular Formula C17H15BrO2
Exact Mass 330.025543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Fz1VEzNTr50
Name (5R,1E)-5-Hydroxy-5-(2-bromophenyl)-1-phenyl-1-penten-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.025542721 u
Formula C17H15BrO2
InChI InChI=1S/C17H15BrO2/c18-16-9-5-4-8-15(16)17(20)12-14(19)11-10-13-6-2-1-3-7-13/h1-11,17,20H,12H2/b11-10+/t17-/m1/s1
InChIKey CFDXSXSSMCNNKK-SXSDINLZSA-N
Molecular Weight 331.209 g/mol
SMILES C=1([C@@](CC(\C=C\C=2C=CC=CC2)=O)(O)[H])C(Br)=CC=CC1