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Methyl 2-(methylthio)butyrate

PropertiesImage
MNX_IDMNXM127932 Image of MNXM127932
referencechebi:165635
formulaC6H12O2S
global charge0
mol weight148.227
InChIKeyPBYSEUNXLXTEAN-UHFFFAOYSA-N
InChIInChI=1S/C6H12O2S/c1-4-5(9-3)6(7)8-2/h5H,4H2,1-3H3
SMILESCCC(SC)C(=O)OC
MNX internals
InChI (mnx)InChI=1/C6H12O2S/c1-4-5(9-3)6(7)8-2/h5H,4H2,1-3H3/t5? Image of MNXM127932
SMILES (mnx)[CH3:1][CH2:4][CH:5]([C:6](=[O:7])[O:8][CH3:2])[S:9][CH3:3]
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:165635
chebi:165635
PBYSEUNXLXTEAN-UHFFFAOYSA-N
Methyl 2-(methylthio)butyrate
methyl 2-methylsulanylbutanoate
hmdb:HMDB0041306
PBYSEUNXLXTEAN-UHFFFAOYSA-N
Methyl 2-(methylthio)butyrate
FEMA 3708
Methyl 2-(methylthio)butyric acid
methyl 2-(methylsulfanyl)butanoate

lipidmaps:LMFA07010938
lipidmapsM:LMFA07010938
PBYSEUNXLXTEAN-UHFFFAOYSA-N
Methyl 2-(methylthio)butyrate
methyl 2-(methylsulfanyl)butanoate

hmdb:HMDB41306
secondary/obsolete/fantasy identifier