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(+/-)-(CIS)-N,N-DIMETHYL-2-(2-HEPTYLOXY-PHENYL-CARBAMOYLOXY)-CYCLOHEPTHYL-METHYLAMMONIUM-CHLORIDE
SpectraBase Compound ID BVeYHRNd3nw
InChI InChI=1S/C24H40N2O3.ClH/c1-4-5-6-7-13-18-28-23-17-12-11-15-21(23)25-24(27)29-22-16-10-8-9-14-20(22)19-26(2)3;/h11-12,15,17,20,22H,4-10,13-14,16,18-19H2,1-3H3,(H,25,27);1H/t20-,22-;/m1./s1
InChIKey ZRJDAWDDCQOQPS-BNBNXSKYSA-N
Mol Weight 441.1 g/mol
Molecular Formula C24H41ClN2O3
Exact Mass 440.280571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GxO8vjD9IFP
Name (+/-)-(CIS)-N,N-DIMETHYL-2-(2-HEPTYLOXY-PHENYL-CARBAMOYLOXY)-CYCLOHEPTHYL-METHYLAMMONIUM-CHLORIDE
Compound Number P2-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H41ClN2O3
InChI InChI=1S/C24H40N2O3.ClH/c1-4-5-6-7-13-18-28-23-17-12-11-15-21(23)25-24(27)29-22-16-10-8-9-14-20(22)19-26(2)3;/h11-12,15,17,20,22H,4-10,13-14,16,18-19H2,1-3H3,(H,25,27);1H/t20-,22-;/m1./s1
InChIKey ZRJDAWDDCQOQPS-BNBNXSKYSA-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 441.054 g/mol
Source File Reference UWIR3460