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(Q105298488)
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English
(2R,3S,6S)-2-ethyl-3-methyl-6-propan-2-ylcyclohexan-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-ethyl-6-isopropyl-3-methylcyclohexan-1-one
1 reference
based on heuristic
inferred from SMILES
mass
182.167065324
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(2R,3S,6R)-2-ethyl-3-methyl-6-propan-2-ylcyclohexan-1-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₂₂O
0 references
canonical SMILES
O=C1C(CCC(C)C1CC)C(C)C
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isomeric SMILES
CC[C@H]1C(=O)[C@H](C(C)C)CC[C@@H]1C
0 references
found in taxon
Cupressus bakeri
1 reference
stated in
cis-calamenene-related sesquiterpenoids from Cupressus bakeri foliage
Hesperocyparis bakeri
1 reference
stated in
cis-calamenene-related sesquiterpenoids from Cupressus bakeri foliage
Identifiers
InChI
InChI=1S/C12H22O/c1-5-10-9(4)6-7-11(8(2)3)12(10)13/h8-11H,5-7H2,1-4H3/t9-,10+,11-/m0/s1
0 references
InChIKey
VXGVKPGULBZBOZ-AXFHLTTASA-N
0 references
PubChem CID
101667554
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
96539559
1 reference
stated in
UniChem
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