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(Q82584703)
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English
(1S)-5,5-Dimethylbicyclo[2.1.1]hexane-1-carboxylic acid
group of stereoisomers with the chemical formula C₉H₁₄O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
154.099379688
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₄O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC1(C)C2CCC1(C(=O)O)C2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC1(C)C2CC[C@]1(C(=O)O)C2
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H14O2/c1-8(2)6-3-4-9(8,5-6)7(10)11/h6H,3-5H2,1-2H3,(H,10,11)/t6?,9-/m1/s1
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InChIKey
CMISKJNMLQUXEF-IOJJLOCKSA-N
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CAS Registry Number
154726-27-9
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PubChem CID
45084804
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
55369005
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20665716
0 references
DSSTOX compound identifier
DTXCID20616465
0 references
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