3-chloro-1-phenyl-1-propanone (CHEBI:232113)

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CHEBI:232113 - 3-chloro-1-phenyl-1-propanone

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ChEBI ID	CHEBI:232113
ChEBI Name	3-chloro-1-phenyl-1-propanone
Stars
Submitter	Anne Morgat
Downloads	Molfile

Formula	C9H9ClO
Net Charge	0
Average Mass	168.623
Monoisotopic Mass	168.03419
SMILES	O=C(CCCl)c1ccccc1
InChI	InChI=1S/C9H9ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey	KTJRGPZVSKWRTJ-UHFFFAOYSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-chloro-1-phenyl-1-propanone (CHEBI:232113) is a acetophenones (CHEBI:22187)
	3-chloro-1-phenyl-1-propanone (CHEBI:232113) is a organochlorine compound (CHEBI:36683)

UniProt Name	Source
3-chloro-1-phenyl-1-propanone	UniProt

Manual Xrefs	Databases
CPD-15523	MetaCyc

Citations