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(+/-)-(CIS)-N,N-DIMETHYL-2-(2-PROPOXY-PHENYL-CARBAMOYLOXY)-CYCLOHEPTHYL-METHYLAMMONIUM-CHLORIDE

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(+/-)-(CIS)-N,N-DIMETHYL-2-(2-PROPOXY-PHENYL-CARBAMOYLOXY)-CYCLOHEPTHYL-METHYLAMMONIUM-CHLORIDE
SpectraBase Compound ID 2dDEBGkKlrl
InChI InChI=1S/C20H32N2O3.ClH/c1-4-14-24-19-13-9-8-11-17(19)21-20(23)25-18-12-7-5-6-10-16(18)15-22(2)3;/h8-9,11,13,16,18H,4-7,10,12,14-15H2,1-3H3,(H,21,23);1H/t16-,18-;/m1./s1
InChIKey RALLGTSMEQUSFL-PHJLCXHGSA-N
Mol Weight 384.9 g/mol
Molecular Formula C20H33ClN2O3
Exact Mass 384.217971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DT4cX96i9La
Name (+/-)-(CIS)-N,N-DIMETHYL-2-(2-PROPOXY-PHENYL-CARBAMOYLOXY)-CYCLOHEPTHYL-METHYLAMMONIUM-CHLORIDE
Compound Number P2-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H33ClN2O3
InChI InChI=1S/C20H32N2O3.ClH/c1-4-14-24-19-13-9-8-11-17(19)21-20(23)25-18-12-7-5-6-10-16(18)15-22(2)3;/h8-9,11,13,16,18H,4-7,10,12,14-15H2,1-3H3,(H,21,23);1H/t16-,18-;/m1./s1
InChIKey RALLGTSMEQUSFL-PHJLCXHGSA-N
Literature Reference Author F.GREGAN,J.GREGAN,M.SKORSEPA
Literature Reference Citation CHEM.PHARM.BULL.,59,978(2011)
Literature Reference DOI 10.1248/cpb.59.978
Molecular Weight 384.947 g/mol
Source File Reference UWIR3456