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3-(p-heptybenzoyl)-2-methyl-1-(6-methyl-2-pyridyl)-2-thiopseudourea

View entire compound with spectra: 2 NMR, and 1 FTIR

3-(p-heptybenzoyl)-2-methyl-1-(6-methyl-2-pyridyl)-2-thiopseudourea
SpectraBase Compound ID tgmssLyQ96
InChI InChI=1S/C22H29N3OS/c1-4-5-6-7-8-11-18-13-15-19(16-14-18)21(26)25-22(27-3)24-20-12-9-10-17(2)23-20/h9-10,12-16H,4-8,11H2,1-3H3,(H,23,24,25,26)
InChIKey XPVNISRBIMZKMK-UHFFFAOYSA-N
Mol Weight 383.55 g/mol
Molecular Formula C22H29N3OS
Exact Mass 383.203134 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HxdHfom30Q5
Name 3-(p-HEPTYLBENZOYL)-2-METHYL-1-(6-METHYL-2-PYRIDYL)-2-THIOPSEUDOUREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29N3OS
InChI InChI=1S/C22H29N3OS/c1-4-5-6-7-8-11-18-13-15-19(16-14-18)21(26)25-22(27-3)24-20-12-9-10-17(2)23-20/h9-10,12-16H,4-8,11H2,1-3H3,(H,23,24,25,26)
InChIKey XPVNISRBIMZKMK-UHFFFAOYSA-N
Molecular Weight 383.56
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20