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4-[[Benzoyl-(4-fluoro-phenyl)-amino]-methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID GyU93Vsjv5o
InChI InChI=1S/C23H23FN2O3/c1-4-29-23(28)21-15(2)20(16(3)25-21)14-26(19-12-10-18(24)11-13-19)22(27)17-8-6-5-7-9-17/h5-13,25H,4,14H2,1-3H3
InChIKey NREJZJJUWXDCBL-UHFFFAOYSA-N
Mol Weight 394.45 g/mol
Molecular Formula C23H23FN2O3
Exact Mass 394.169271 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HaZbpM4aDLV
Name 1H-pyrrole-2-carboxylic acid, 4-[[benzoyl(4-fluorophenyl)amino]methyl]-3,5-dimethyl-, 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 394.169270769 u
Formula C23H23FN2O3
InChI InChI=1S/C23H23FN2O3/c1-4-29-23(28)21-15(2)20(16(3)25-21)14-26(19-12-10-18(24)11-13-19)22(27)17-8-6-5-7-9-17/h5-13,25H,4,14H2,1-3H3
InChIKey NREJZJJUWXDCBL-UHFFFAOYSA-N
Molecular Weight 394.446 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17746
Solvent DMSO-d6
Source Vendor ID: NMR/10310785; Lab Info: KOVA; Lab Number: KOVA-0000083