2-(p-chlorophenyl)-3-methyl-2,3-Butanediol mixed with 4-(beta-cyclohexyl-beta-hydroxyphenethyl)-1,1-dimethylpiperazinium sulfate (4:1)
[CAS# 76485-09-1]

Identification

• Name: 2-(p-chlorophenyl)-3-methyl-2,3-Butanediol mixed with 4-(beta-cyclohexyl-beta-hydroxyphenethyl)-1,1-dimethylpiperazinium sulfate (4:1)
• Synonyms: 2-(4-Chlorophenyl)-3-Methyl-Butane-2,3-Diol; 1-Cyclohexyl-2-(4,4-Dimethylpiperazin-4-Ium-1-Yl)-1-Phenyl-Ethanol; Methanesulfonate; 2-(4-Chlorophenyl)-3-Methylbutane-2,3-Diol; 1-Cyclohexyl-2-(4,4-Dimethyl-1-Piperazin-4-Iumyl)-1-Phenylethanol; Methanesulfonate
• Molecular Formula: C₃₂H₅₁ClN₂O₆S
• Molecular Weight: 627.28
• CAS Registry Number: 76485-09-1
• SMILES: C1=C(C(O)(C(O)(C)C)C)C=CC(=C1)Cl.C[S]([O-])(=O)=O.C(N2CC[N+](CC2)(C)C)C(O)(C3=CC=CC=C3)C4CCCCC4
• InChI: 1S/C20H33N2O.C11H15ClO2.CH4O3S/c1-22(2)15-13-21(14-16-22)17-20(23,18-9-5-3-6-10-18)19-11-7-4-8-12-19;1-10(2,13)11(3,14)8-4-6-9(12)7-5-8;1-5(2,3)4/h3,5-6,9-10,19,23H,4,7-8,11-17H2,1-2H3;4-7,13-14H,1-3H3;1H3,(H,2,3,4)/q+1;;/p-1
• InChIKey: PQNDIZBCHMMKKR-UHFFFAOYSA-M