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CHEBI:194682 - 1-Chloro-3-(methylsulfinyl)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-one

ChEBI IDCHEBI:194682
ChEBI Name1-Chloro-3-(methylsulfinyl)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-one
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SubmitterMetaboLights
DownloadsMolfile
FormulaC9H9ClO2S2
Net Charge0
Average Mass248.756
Monoisotopic Mass247.97325
SMILESCS(=O)c1sc(Cl)c2c1C(=O)CCC2
InChIInChI=1S/C9H9ClO2S2/c1-14(12)9-7-5(8(10)13-9)3-2-4-6(7)11/h2-4H2,1H3
InChIKeyPGSSJIDFZJTWLZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-Chloro-3-(methylsulfinyl)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-one (CHEBI:194682) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
1-chloro-3-methylsulinyl-6,7-dihydro-5H-2-benzothiophen-4-one
Manual XrefsDatabases
2099129ChemSpider