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1-[(1R,2R)-2-amino-1,2-di(phenyl)ethyl]-3-(3,4-dimethoxyphenyl)thiourea
SpectraBase Compound ID EchxQwFMiZO
InChI InChI=1S/C23H25N3O2S/c1-27-19-14-13-18(15-20(19)28-2)25-23(29)26-22(17-11-7-4-8-12-17)21(24)16-9-5-3-6-10-16/h3-15,21-22H,24H2,1-2H3,(H2,25,26,29)/t21-,22-/m1/s1
InChIKey SPFVCIINCQHJFA-FGZHOGPDSA-N
Mol Weight 407.53 g/mol
Molecular Formula C23H25N3O2S
Exact Mass 407.166748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G7fRQPEpveL
Name 1-[(1R,2R)-2-amino-1,2-di(phenyl)ethyl]-3-(3,4-dimethoxyphenyl)thiourea
Compound Number (1R,2R)-#7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H25N3O2S
InChI InChI=1S/C23H25N3O2S/c1-27-19-14-13-18(15-20(19)28-2)25-23(29)26-22(17-11-7-4-8-12-17)21(24)16-9-5-3-6-10-16/h3-15,21-22H,24H2,1-2H3,(H2,25,26,29)/t21-,22-/m1/s1
InChIKey SPFVCIINCQHJFA-FGZHOGPDSA-N
Literature Reference Author N.MIBU,K.YOKOMIZO,T.MIYATA,K.SUMOTO
Literature Reference Citation CHEM.PHARM.BULL.,55,1406(2007)
Literature Reference DOI 10.1248/cpb.55.1406
Molecular Weight 407.530 g/mol
Sample ID 56208
Solvent CDCl3