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English
(1S)-4-Methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-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
0 references
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
C=C1C(=O)CC2(C(C)C)CC12
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C=C1C(=O)C[C@]2(C(C)C)CC12
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C10H14O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6,8H,3-5H2,1-2H3/t8?,10-/m0/s1
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InChIKey
PBLWMCQDAGOTPV-HTLJXXAVSA-N
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CAS Registry Number
67690-48-6
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PubChem CID
57358490
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
50997130
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20724130
0 references
DSSTOX compound identifier
DTXCID90674875
0 references
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