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Reference substances

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IUPAC name:
Reaction mass of (1R)‐1‐[(1S)‐3,3‐dimethylcyclohexyl]ethyl relacetate and (1R,2R)‐2,6,6‐trimethylcycloheptyl rel‐acetate

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Synonyms

Molecular and structural information

Molecular formula:
C12H22O2
Molecular weight:
198.3
SMILES notation:
CC1(C)CCC[C@@H](C1)[C@@H](C)OC(C)=O
CC(=O)O[C@H]1CC(C)(C)CCC[C@@H]1C
InChl:
InChI=1S/C12H22O2/c1-9(14-10(2)13)11-6-5-7-12(3,4)8-11/h9,11H,5-8H2,1-4H3/t9-,11+/m1/s1
InChI=1S/C12H22O2/c1-9-6-5-7-12(3,4)8-11(9)14-10(2)13/h9,11H,5-8H2,1-4H3/t9-,11-/m0/s1
Structural formula:
Chemical structure

Related substances

Identifier:
CAS number
Identity:
25225-10-9

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