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(Q82909994)
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English
1,7,7-Trimethylbicyclo[2.2.1]hept-5-en-2-one
group of stereoisomers with the chemical formula C₁₀H₁₄O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
150.104465068
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₀H₁₄O
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC12C=CC(CC1=O)C2(C)C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC1(C)C2C=C[C@@]1(C)C(=O)C2
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C10H14O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h4-5,7H,6H2,1-3H3/t7?,10-/m0/s1
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InChIKey
BQJYIYRCGDNPLN-MHPPCMCBSA-N
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CAS Registry Number
15099-93-1
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PubChem CID
193498
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
47665851
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80934137
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DSSTOX compound identifier
DTXCID201362790
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