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1-(4-Bromo-2-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid

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

1-(4-Bromo-2-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid
SpectraBase Compound ID 77Gh3wgM8dM
InChI InChI=1S/C12H12BrNO3/c1-7-4-9(13)2-3-10(7)14-6-8(12(16)17)5-11(14)15/h2-4,8H,5-6H2,1H3,(H,16,17)
InChIKey XZOKUZNXZRYKBF-UHFFFAOYSA-N
Mol Weight 298.14 g/mol
Molecular Formula C12H12BrNO3
Exact Mass 297.000056 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I9ZYEHbr6YL
Name 3-pyrrolidinecarboxylic acid, 1-(4-bromo-2-methylphenyl)-5-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.000056247 u
Formula C12H12BrNO3
InChI InChI=1S/C12H12BrNO3/c1-7-4-9(13)2-3-10(7)14-6-8(12(16)17)5-11(14)15/h2-4,8H,5-6H2,1H3,(H,16,17)
InChIKey XZOKUZNXZRYKBF-UHFFFAOYSA-N
Molecular Weight 298.136 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12409
Solvent DMSO-d6
Source Vendor ID: NMR/10272175; Lab Info: LP; Lab Number: LP-0201564