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CHEBI:173429 - 2,3,6,7-Tetrahydro-7-methylcyclopent[b]azepin-8(1H)-one

ChEBI IDCHEBI:173429
ChEBI Name2,3,6,7-Tetrahydro-7-methylcyclopent[b]azepin-8(1H)-one
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H13NO
Net Charge0
Average Mass163.220
Monoisotopic Mass163.09971
SMILESCC1CC2=C(NCCC=C2)C1=O
InChIInChI=1S/C10H13NO/c1-7-6-8-4-2-3-5-11-9(8)10(7)12/h2,4,7,11H,3,5-6H2,1H3
InChIKeyILPLRBRVDMHSCS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,3,6,7-Tetrahydro-7-methylcyclopent[b]azepin-8(1H)-one (CHEBI:173429) is a azepine (CHEBI:48105)
IUPAC Name 
7-methyl-2,3,6,7-tetrahydro-1H-cyclopenta[b]azepin-8-one
Manual XrefsDatabases
HMDB0039661HMDB
35014849ChemSpider