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(Q82891838)
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English
1-(9-Azabicyclo[4.2.1]non-2-en-2-yl)ethan-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1-[(6S)-9-azabicyclo[4.2.1]non-2-en-2-yl]ethanone
1 reference
based on heuristic
inferred from SMILES
mass
165.1153641
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
1-[(1r,6r)-9-Azabicyclo[4.2.1]non-2-En-2-Yl]ethanone
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₅NO
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(=O)C1=CCCC2CCC1N2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(=O)C1=CCC[C@H]2CC[C@@H]1N2
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C10H15NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h4,8,10-11H,2-3,5-6H2,1H3/t8-,10-/m0/s1
0 references
InChIKey
SGNXVBOIDPPRJJ-WPRPVWTQSA-N
0 references
CAS Registry Number
92142-32-0
0 references
PubChem CID
185149
1 reference
matched by identifier from
InChIKey
InChIKey
SGNXVBOIDPPRJJ-WPRPVWTQSA-N
DSSTox substance ID
DTXSID40919349
1 reference
matched by identifier from
InChIKey
InChIKey
SGNXVBOIDPPRJJ-WPRPVWTQSA-N
DSSTOX compound identifier
DTXCID401021623
0 references
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