For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 1 NMR

benzoic acid, 4-[[[1-(4-fluorophenyl)-5-oxo-3-[3-(1-piperidinyl)propyl]-2-thioxo-4-imidazolidinyl]acetyl]amino]-, ethyl ester
SpectraBase Compound ID J8p9VkA7TOo
InChI InChI=1S/C28H33FN4O4S/c1-2-37-27(36)20-7-11-22(12-8-20)30-25(34)19-24-26(35)33(23-13-9-21(29)10-14-23)28(38)32(24)18-6-17-31-15-4-3-5-16-31/h7-14,24H,2-6,15-19H2,1H3,(H,30,34)
InChIKey LLGRGHGTDROHGZ-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

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7OpPQgPGzVz
Name benzoic acid, 4-[[[1-(4-fluorophenyl)-5-oxo-3-[3-(1-piperidinyl)propyl]-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/c1-2-37-27(36)20-7-11-22(12-8-20)30-25(34)19-24-26(35)33(23-13-9-21(29)10-14-23)28(38)32(24)18-6-17-31-15-4-3-5-16-31/h7-14,24H,2-6,15-19H2,1H3,(H,30,34)
InChIKey LLGRGHGTDROHGZ-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_3835
Solvent DMSO-d6
Source Vendor ID: NMR/13279130