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4-imidazolidineacetamide, N-(4-fluorophenyl)-1-(4-methylphenyl)-3-[3-(4-methyl-1-piperidinyl)propyl]-5-oxo-2-thioxo-
SpectraBase Compound ID 3HyCCpmolcF
InChI InChI=1S/C27H33FN4O2S/c1-19-4-10-23(11-5-19)32-26(34)24(18-25(33)29-22-8-6-21(28)7-9-22)31(27(32)35)15-3-14-30-16-12-20(2)13-17-30/h4-11,20,24H,3,12-18H2,1-2H3,(H,29,33)
InChIKey XCQALVXTGMWSAC-UHFFFAOYSA-N
Mol Weight 496.6 g/mol
Molecular Formula C27H33FN4O2S
Exact Mass 496.230826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5oUpQx30ndh
Name 4-imidazolidineacetamide, N-(4-fluorophenyl)-1-(4-methylphenyl)-3-[3-(4-methyl-1-piperidinyl)propyl]-5-oxo-2-thioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 496.230825654 u
Formula C27H33FN4O2S
InChI InChI=1S/C27H33FN4O2S/c1-19-4-10-23(11-5-19)32-26(34)24(18-25(33)29-22-8-6-21(28)7-9-22)31(27(32)35)15-3-14-30-16-12-20(2)13-17-30/h4-11,20,24H,3,12-18H2,1-2H3,(H,29,33)
InChIKey XCQALVXTGMWSAC-UHFFFAOYSA-N
Molecular Weight 496.645 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2379
Solvent DMSO-d6
Source Vendor ID: NMR/13268705