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Ethyl [2-(4-bromophenyl)-3-(4-chlorobenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]acetate
SpectraBase Compound ID KkBIa5GSMpn
InChI InChI=1S/C21H17BrClNO5/c1-2-29-16(25)11-24-18(12-3-7-14(22)8-4-12)17(20(27)21(24)28)19(26)13-5-9-15(23)10-6-13/h3-10,18,27H,2,11H2,1H3
InChIKey WIXQQNQJVNIZIL-UHFFFAOYSA-N
Mol Weight 478.73 g/mol
Molecular Formula C21H17BrClNO5
Exact Mass 476.997863 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Erq7dI7Oql9
Name 1H-pyrrole-1-acetic acid, 2-(4-bromophenyl)-3-(4-chlorobenzoyl)-2,5-dihydro-4-hydroxy-5-oxo-, 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 476.997863346 u
Formula C21H17BrClNO5
InChI InChI=1S/C21H17BrClNO5/c1-2-29-16(25)11-24-18(12-3-7-14(22)8-4-12)17(20(27)21(24)28)19(26)13-5-9-15(23)10-6-13/h3-10,18,27H,2,11H2,1H3
InChIKey WIXQQNQJVNIZIL-UHFFFAOYSA-N
Molecular Weight 478.726 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17669
Solvent DMSO-d6
Source Vendor ID: NMR/11211253; Lab Info: GEI; Lab Number: GEI-PFA0680