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phenylacetone

PropertiesImage
MNX_IDMNXM4774 Image of MNXM4774
referencechebi:52052
formulaC9H10O
global charge0
mol weight134.178
InChIKeyQCCDLTOVEPVEJK-UHFFFAOYSA-N
InChIInChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
SMILESCC(=O)CC1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3 Image of MNXM4774
SMILES (mnx)[CH3:1][C:8]([CH2:7][C:9]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)=[O:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:52052
chebi:52052
QCCDLTOVEPVEJK-UHFFFAOYSA-N
phenylacetone
1-Phenyl-2-propanone
1-phenylpropan-2-one
3-Phenyl-2-propanone
Benzyl methyl ketone
Methyl benzyl ketone
Phenyl-2-propanone
Phenylacetone
Phenylmethyl methyl ketone

sabiork.compound:30071
sabiorkM:30071
QCCDLTOVEPVEJK-UHFFFAOYSA-N
1-Phenylpropan-2-one

sabiork.compound:23134
sabiorkM:23134
QCCDLTOVEPVEJK-UHFFFAOYSA-N
Phenylacetone

kegg.compound:C15512
keggC:C15512
QCCDLTOVEPVEJK-UHFFFAOYSA-N
Phenylacetone
1-Phenyl-2-propanone

seed.compound:cpd11192
seedM:cpd11192
QCCDLTOVEPVEJK-UHFFFAOYSA-N
Phenylacetone
1-Phenyl-2-propanone
phenyl acetone
phenylacetone

envipath:...aee4214ec67d
envipathM:...aee4214ec67d
QCCDLTOVEPVEJK-UHFFFAOYSA-N
compound 0048322

metacyc.compound:CPD-7233
metacycM:CPD-7233
QCCDLTOVEPVEJK-UHFFFAOYSA-N
phenylacetone
phenyl acetone

keggC:M_C15512
seedM:M_cpd11192
secondary/obsolete/fantasy identifier