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6-(4-Bromo-phenyl)-3-ethyl-4-oxo-3-phenyl-hex-5-enoic acid ethyl ester

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

6-(4-Bromo-phenyl)-3-ethyl-4-oxo-3-phenyl-hex-5-enoic acid ethyl ester
SpectraBase Compound ID 86UNl86GLj
InChI InChI=1S/C22H23BrO3/c1-3-22(16-21(25)26-4-2,18-8-6-5-7-9-18)20(24)15-12-17-10-13-19(23)14-11-17/h5-15H,3-4,16H2,1-2H3/b15-12+
InChIKey JFUKNMRLBFDUGK-NTCAYCPXSA-N
Mol Weight 415.33 g/mol
Molecular Formula C22H23BrO3
Exact Mass 414.083058 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BygyLUDnEuh
Name benzenepropanoic acid, beta-[(2E)-3-(4-bromophenyl)-1-oxo-2-propenyl]-beta-ethyl-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.083057598 u
Formula C22H23BrO3
InChI InChI=1S/C22H23BrO3/c1-3-22(16-21(25)26-4-2,18-8-6-5-7-9-18)20(24)15-12-17-10-13-19(23)14-11-17/h5-15H,3-4,16H2,1-2H3/b15-12+
InChIKey JFUKNMRLBFDUGK-NTCAYCPXSA-N
Molecular Weight 415.327 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15673
Solvent DMSO-d6
Source Vendor ID: NMR/10301780; Lab Info: GEI; Lab Number: GEI-Scor133