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Reference substances

Reference substances

IUPAC name:
1,1,2,3,3-pentamethyl-2,3,4,5,6,7-hexahydro-1H-inden-4-one

Inventory

EC number:
251-649-3
EC name:
1,2,3,5,6,7-hexahydro-1,1,2,3,3-pentamethyl-4H-inden-4-one
CAS number:
33704-61-9
CAS number:
33704-61-9
Synonyms
Names:
4(5H)-Indanone, 6,7-dihydro-1,1,2,3,3-pentamethyl-
4H-Inden-4-one, 1,2,3,5,6,7-hexahydro-1,1,2,3,3-pentamethyl-
Identifier:
other: SMILES notation
CC1C(C)(C)C2=C(C(=O)CCC2)C1(C)C
1,1,2,3,3-pentamethyl-1,2,3,5,6,7-hexahydro-4H-inden-4-one

Molecular and structural information

Molecular formula:
C14H22O
Molecular weight:
206.324
SMILES notation:
O=C(C(=C(C(C1C)(C)C)CC2)C1(C)C)C2
InChl:
InChI=1/C14H22O/c1-9-13(2,3)10-7-6-8-11(15)12(10)14(9,4)5/h9H,6-8H2,1-5H3
Structural formula:
Chemical structure

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