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benzoic acid, 4-[[[1-(4-fluorophenyl)-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, ethyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 4-[[[1-(4-fluorophenyl)-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, ethyl ester
SpectraBase Compound ID 4e3v9XZhpg
InChI InChI=1S/C28H33FN4O4S/c1-3-37-27(36)20-4-8-22(9-5-20)30-25(34)18-24-26(35)33(23-10-6-21(29)7-11-23)28(38)32(24)17-16-31-14-12-19(2)13-15-31/h4-11,19,24H,3,12-18H2,1-2H3,(H,30,34)
InChIKey XETAODNTPQQOEI-UHFFFAOYSA-N
Mol Weight 540.7 g/mol
Molecular Formula C28H33FN4O4S
Exact Mass 540.220655 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IJd1BW0zCh3
Name benzoic acid, 4-[[[1-(4-fluorophenyl)-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl]acetyl]amino]-, 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 540.220654892 u
Formula C28H33FN4O4S
InChI InChI=1S/C28H33FN4O4S/c1-3-37-27(36)20-4-8-22(9-5-20)30-25(34)18-24-26(35)33(23-10-6-21(29)7-11-23)28(38)32(24)17-16-31-14-12-19(2)13-15-31/h4-11,19,24H,3,12-18H2,1-2H3,(H,30,34)
InChIKey XETAODNTPQQOEI-UHFFFAOYSA-N
Molecular Weight 540.654 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2368
Solvent DMSO-d6
Source Vendor ID: NMR/13268691