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English
(2R)-Methyl 2-methyl-5-oxocyclopentanecarboxylate
group of stereoisomers with the chemical formula C₈H₁₂O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
156.078644244
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₂O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COC(=O)C1C(=O)CCC1C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC(=O)C1C(=O)CC[C@H]1C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C8H12O3/c1-5-3-4-6(9)7(5)8(10)11-2/h5,7H,3-4H2,1-2H3/t5-,7?/m1/s1
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InChIKey
SVYJAKSNXZQAQI-FOUAAFFMSA-N
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CAS Registry Number
92344-02-0
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PubChem CID
10942702
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
24669196
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70449124
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DSSTOX compound identifier
DTXCID40399945
0 references
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