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(Q115947231)
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English
4-Hydroxy-3,3,5-trimethylcyclohexanone
group of stereoisomers with the chemical formula C₉H₁₆O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
156.115029752
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₆O₂
0 references
canonical SMILES
O=C1CC(C)C(O)C(C)(C)C1
0 references
found in taxon
Nicotiana tabacum
1 reference
stated in
A Chemical Study of Burley Tobacco Flavour (Nicotiana tabacum L.). I. Volatile to medium-volatile constituents (b.p. ≦ 84°/0.001 Torr
Identifiers
InChI
InChI=1S/C9H16O2/c1-6-4-7(10)5-9(2,3)8(6)11/h6,8,11H,4-5H2,1-3H3
0 references
InChIKey
CZFNEULXUXGILY-UHFFFAOYSA-N
0 references
PubChem CID
21200670
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CZFNEULXUXGILY-UHFFFAOYSA-N
UniChem compound ID
26887777
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID301283137
1 reference
matched by identifier from
InChIKey
InChIKey
CZFNEULXUXGILY-UHFFFAOYSA-N
KNApSAcK ID
C00060723
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CZFNEULXUXGILY-UHFFFAOYSA-N
UNII
8C72Q10O8G
1 reference
matched by identifier from
InChIKey
InChIKey
CZFNEULXUXGILY-UHFFFAOYSA-N
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