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(Q82750712)
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English
(6Z)-1H-Pyrrolo[2,3-d]azocine
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
144.068748256
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₈N₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C1=C\c2cc[nH]c2/C=C\N=C/1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
C1=C\c2cc[nH]c2/C=C\N=C/1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H8N2/c1-2-8-3-7-11-9(8)4-6-10-5-1/h1-7,11H/b2-1?,5-1-,6-4?,8-2-,9-4+,10-5-,10-6-
0 references
InChIKey
LHVDBYUBKHUSBF-FSNNOGHSSA-N
0 references
CAS Registry Number
499136-98-0
0 references
DSSTox substance ID
DTXSID30785156
0 references
DSSTOX compound identifier
DTXCID90735899
0 references
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