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1-[(1R,2R)-2-aminocyclohexyl]-3-(3,4-dimethoxyphenyl)thiourea hydrochloride
SpectraBase Compound ID 5pZ4G5KirRs
InChI InChI=1S/C15H23N3O2S.ClH/c1-19-13-8-7-10(9-14(13)20-2)17-15(21)18-12-6-4-3-5-11(12)16;/h7-9,11-12H,3-6,16H2,1-2H3,(H2,17,18,21);1H/t11-,12-;/m1./s1
InChIKey DPJYTNRVKVWSJC-MNMPKAIFSA-N
Mol Weight 345.89 g/mol
Molecular Formula C15H24ClN3O2S
Exact Mass 345.127776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LW1ACGOMLbl
Name 1-[(1R,2R)-2-aminocyclohexyl]-3-(3,4-dimethoxyphenyl)thiourea hydrochloride
Compound Number (1R,2R)-#6C.HCL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H24ClN3O2S
InChI InChI=1S/C15H23N3O2S.ClH/c1-19-13-8-7-10(9-14(13)20-2)17-15(21)18-12-6-4-3-5-11(12)16;/h7-9,11-12H,3-6,16H2,1-2H3,(H2,17,18,21);1H/t11-,12-;/m1./s1
InChIKey DPJYTNRVKVWSJC-MNMPKAIFSA-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 345.887 g/mol
Sample ID 56211
Solvent DMSO-D6