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Dimethyl 2-benzoyl-3-(4-bromophenyl)-2-ethyl-1,1-cyclopropanedicarboxylate
SpectraBase Compound ID 19IGNR3OCnP
InChI InChI=1S/C22H21BrO5/c1-4-21(18(24)15-8-6-5-7-9-15)17(14-10-12-16(23)13-11-14)22(21,19(25)27-2)20(26)28-3/h5-13,17H,4H2,1-3H3
InChIKey CSUOQOAYHSWOFO-UHFFFAOYSA-N
Mol Weight 445.31 g/mol
Molecular Formula C22H21BrO5
Exact Mass 444.057237 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ISRBbrK1nim
Name 1,1-cyclopropanedicarboxylic acid, 2-benzoyl-3-(4-bromophenyl)-2-ethyl-, dimethyl 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 444.057236771 u
Formula C22H21BrO5
InChI InChI=1S/C22H21BrO5/c1-4-21(18(24)15-8-6-5-7-9-15)17(14-10-12-16(23)13-11-14)22(21,19(25)27-2)20(26)28-3/h5-13,17H,4H2,1-3H3
InChIKey CSUOQOAYHSWOFO-UHFFFAOYSA-N
Molecular Weight 445.309 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2566
Solvent DMSO-d6
Source Vendor ID: NMR/9233659; Lab Info: GEI; Lab Number: GEI-Tsh0006
Temperature 29.85 °C