Analyte Name

Carnosic Acid-D3

Molecular Formula

C20 D3 H25 O4

Molecular Weight

335.452

Accurate Mass

335.218

SMILES

[2H]C(C)(C)c1cc2c(c(O)c1O)[C@]3(CCCC(C)(C)[C@@H]3CC2([2H])[2H])C(=O)O

InChI

InChI=1S/C20H28O4/c1-11(2)13-10-12-6-7-14-19(3,4)8-5-9-20(14,18(23)24)15(12)17(22)16(13)21/h10-11,14,21-22H,5-9H2,1-4H3,(H,23,24)/t14-,20+/m0/s1/i6D2,11D

IUPAC

(4aR,10aS)-9,9-dideuterio-7-(2-deuteriopropan-2-yl)-5,6-dihydroxy-1,1-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid

Unlabelled CAS Number

3650-09-7

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat