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(Q115947986)
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English
2-Pentanone, 4-(2,6,6-trimethyl-2-cyclohexenyl)
group of stereoisomers with the chemical formula C₁₄H₂₄O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
208.182715388
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₂₄O
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canonical SMILES
O=C(C)CC(C)C1C(=CCCC1(C)C)C
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found in taxon
Nicotiana tabacum
1 reference
stated in
Comparison of different extraction methods: steam distillation, simultaneous distillation and extraction and headspace co-distillation, used for the analysis of the volatile components in aged flue-cured tobacco leaves
Identifiers
InChI
InChI=1S/C14H24O/c1-10-7-6-8-14(4,5)13(10)11(2)9-12(3)15/h7,11,13H,6,8-9H2,1-5H3
0 references
InChIKey
RAUXIXDTPYPKTH-UHFFFAOYSA-N
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PubChem CID
579168
1 reference
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
SureChEMBL ID
SCHEMBL9418360
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RAUXIXDTPYPKTH-UHFFFAOYSA-N
UniChem compound ID
25487993
1 reference
stated in
UniChem
KNApSAcK ID
C00062239
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RAUXIXDTPYPKTH-UHFFFAOYSA-N
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