Analyte Name

6-Dehydroestrone

CAS Number

2208-12-0

Molecular Formula

C18 H20 O2

Molecular Weight

268.35

Accurate Mass

268.146

SMILES

C[C@]12CC[C@H]3[C@@H](C=Cc4cc(O)ccc34)[C@@H]1CCC2=O

InChI

InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,10,14-16,19H,6-9H2,1H3/t14-,15-,16+,18+/m1/s1

IUPAC

(8R,9S,13S,14S)-3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-17-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat