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4-(Methylthio)-2-pentanone

PropertiesImage
MNX_IDMNXM117818 Image of MNXM117818
referencechebi:173353
formulaC6H12OS
global charge0
mol weight132.228
InChIKeyPNJBGQMNUMZADU-UHFFFAOYSA-N
InChIInChI=1S/C6H12OS/c1-5(7)4-6(2)8-3/h6H,4H2,1-3H3
SMILESCSC(C)CC(C)=O
MNX internals
InChI (mnx)InChI=1/C6H12OS/c1-5(7)4-6(2)8-3/h6H,4H2,1-3H3/t6? Image of MNXM117818
SMILES (mnx)[CH3:1][C:5]([CH2:4][CH:6]([CH3:2])[S:8][CH3:3])=[O:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:173353
chebi:173353
PNJBGQMNUMZADU-UHFFFAOYSA-N
4-(Methylthio)-2-pentanone
4-methylsulanylpentan-2-one
hmdb:HMDB0032430
PNJBGQMNUMZADU-UHFFFAOYSA-N
4-(Methylthio)-2-pentanone
4-(Methylsulphanyl)pentan-2-one
4-(methylsulfanyl)pentan-2-one

hmdb:HMDB32430
secondary/obsolete/fantasy identifier