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(Q82145685)
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English
Ethanone, 1-(1S,2R,4S)-bicyclo[2.2.1]hept-5-en-2-yl- (9CI)
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
136.088815004
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
endo-2-Acetyl-5-norbornene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₂O
0 references
canonical SMILES
CC(=O)C1CC2C=CC1C2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(=O)[C@@H]1C[C@@H]2C[C@H]1C=C2
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Identifiers
InChI
InChI=1S/C9H12O/c1-6(10)9-5-7-2-3-8(9)4-7/h2-3,7-9H,4-5H2,1H3/t7-,8+,9-/m0/s1
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InChIKey
NIMLCWCLVJRPFY-YIZRAAEISA-N
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CAS Registry Number
159651-24-8
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PubChem CID
1381939
1 reference
matched by identifier from
InChIKey
InChIKey
NIMLCWCLVJRPFY-YIZRAAEISA-N
UniChem compound ID
42168506
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70362526
1 reference
matched by identifier from
InChIKey
InChIKey
NIMLCWCLVJRPFY-YIZRAAEISA-N
DSSTOX compound identifier
DTXCID90313575
0 references
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