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(Q82817435)
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English
(1E)-1-(3-Bromophenyl)-N-(prop-1-en-1-yl)ethan-1-imine
group of stereoisomers with the chemical formula C₁₁H₁₂BrN
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
237.015311484
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₂BrN
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC=C/N=C(\C)c1cccc(Br)c1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CC=C/N=C(\C)c1cccc(Br)c1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C11H12BrN/c1-3-7-13-9(2)10-5-4-6-11(12)8-10/h3-8H,1-2H3/b7-3?,13-9+
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InChIKey
HEVJRPNWYKDAPO-RMJSBZNVSA-N
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CAS Registry Number
87869-65-6
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DSSTox substance ID
DTXSID90831502
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DSSTOX compound identifier
DTXCID10782244
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