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p-[3-(2-cyanoethyl)-3-cyclohexyl-2-thioureido]benzoic acid, ethyl ester
SpectraBase Compound ID 9BbKNxRL66N
InChI InChI=1S/C19H25N3O2S/c1-2-24-18(23)15-9-11-16(12-10-15)21-19(25)22(14-6-13-20)17-7-4-3-5-8-17/h9-12,17H,2-8,14H2,1H3,(H,21,25)
InChIKey ZTPASRSYNFWNBH-UHFFFAOYSA-N
Mol Weight 359.49 g/mol
Molecular Formula C19H25N3O2S
Exact Mass 359.166748 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9b02NUZalrX
Name p-[3-(2-cyanoethyl)-3-cyclohexyl-2-thioureido]benzoic acid, ethyl ester
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Formula C19H25N3O2S
InChI InChI=1S/C19H25N3O2S/c1-2-24-18(23)15-9-11-16(12-10-15)21-19(25)22(14-6-13-20)17-7-4-3-5-8-17/h9-12,17H,2-8,14H2,1H3,(H,21,25)
InChIKey ZTPASRSYNFWNBH-UHFFFAOYSA-N
Instrument Name Varian A-60D
Sadtler NMR Number 17762M
Solvent Polysol