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Reference substances

Reference substances

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General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
potassium 1,4a,8-trimethyl-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylate

Molecular and structural information

Molecular formula:
C21H29KO2
Molecular weight:
ca. 352.5
SMILES notation:
CC(C)c3ccc2c(CCC1C2(C)CCCC1(C)C(=O)O[K])c3C
InChl:
InChI=1/C21H30O2.K/c1-13(2)15-7-9-17-16(14(15)3)8-10-18-20(17,4)11-6-12-21(18,5)19(22)23;/h7,9,13,18H,6,8,10-12H2,1-5H3,(H,22,23);/q;+1/p-1
Structural formula:
Chemical structure