Analyte Name

(1R,2R,3R)-3-[N-(4-Methoxybenzyl)imidomethylthiomethoxy]-1,2-dihydroxy-4-cyclopropene 1,2-Cyclohexyl Ketal

Molecular Formula

C21 H27 N O4 S

Molecular Weight

389.508

Accurate Mass

389.166

SMILES

COc1ccc(C\N=C(\O[C@@H]2C=C[C@@H]3OC4(CCCCC4)O[C@H]23)/SC)cc1

InChI

InChI=1S/C21H27NO4S/c1-23-16-8-6-15(7-9-16)14-22-20(27-2)24-17-10-11-18-19(17)26-21(25-18)12-4-3-5-13-21/h6-11,17-19H,3-5,12-14H2,1-2H3/b22-20-/t17-,18+,19-/m1/s1

IUPAC

[(3aS,4R,6aS)-spiro[4,6a-dihydro-3aH-cyclopenta[d][1,3]dioxole-2,1'-cyclohexane]-4-yl] (1Z)-N-[(4-methoxyphenyl)methyl]-1-methylsulfanylmethanimidate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat