Androsta-1,4,6-triene-3,17-dione (1.0mg/mL in MeOH)

Analyte Name

Androsta-1,4,6-triene-3,17-dione

CAS Number

633-35-2

Molecular Formula

C19 H22 O2

Molecular Weight

282.38

Measured Value

1.0 mg/mL

Accurate Mass

282.162

SMILES

C[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)C=C[C@]34C)[C@@H]1CCC2=O

InChI

InChI=1S/C19H22O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3-4,7,9,11,14-16H,5-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1

IUPAC

(8R,9S,10R,13S,14S)-10,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthrene-3,17-dione

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Methanol