rac-trans 3’-Thiomethyl Nicotine Dihydrochloride

Analyte Name

rac-trans 3'-Thiomethyl Nicotine Dihydrochloride

CAS Number

1246820-13-2

Molecular Formula

C11H16N2S • 2(HCl)

Molecular Weight

280.06

Accurate Mass

280.0568

SMILES

CN1[C@H](C2=CC=CN=C2)[C@@H](CS)CC1.Cl.Cl

InChI

InChI=1S/C11H16N2S.2ClH/c1-13-6-4-10(8-14)11(13)9-3-2-5-12-7-9;;/h2-3,5,7,10-11,14H,4,6,8H2,1H3;2*1H/t10-,11-;;/m1../s1

IUPAC

((2S,3S)-1-methyl-2-(pyridin-3-yl)pyrrolidin-3-yl)methanethiol dihydrochloride

Alternate CAS Number

Free base: 1246820-13-2

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)