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(Q82642559)
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English
(1S)-Bicyclo[2.2.1]heptan-2-one
group of stereoisomers with the chemical formula C₇H₁₀O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
110.07316494
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₇H₁₀O
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C1CC2CCC1C2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
O=C1CC2CC[C@H]1C2
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C7H10O/c8-7-4-5-1-2-6(7)3-5/h5-6H,1-4H2/t5?,6-/m0/s1
0 references
InChIKey
KPMKEVXVVHNIEY-GDVGLLTNSA-N
0 references
CAS Registry Number
2630-41-3
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PubChem CID
54006846
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
26166101
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60708318
0 references
DSSTOX compound identifier
DTXCID90659066
0 references
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