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(S)-3-Methylthiohexyl acetate

PropertiesImage
MNX_IDMNXM115420 Image of MNXM115420
referencechebi:169213
formulaC9H18O2S
global charge0
mol weight190.308
InChIKeyVIQXICKUKPVFRK-UHFFFAOYSA-N
InChIInChI=1S/C9H18O2S/c1-4-5-9(12-3)6-7-11-8(2)10/h9H,4-7H2,1-3H3
SMILESCCCC(CCOC(C)=O)SC
MNX internals
InChI (mnx)InChI=1/C9H18O2S/c1-4-5-9(12-3)6-7-11-8(2)10/h9H,4-7H2,1-3H3/t9? Image of MNXM115420
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH:9]([CH2:6][CH2:7][O:11][C:8]([CH3:2])=[O:10])[S:12][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:169213
chebi:169213
VIQXICKUKPVFRK-UHFFFAOYSA-N 		(S)-3-Methylthiohexyl acetate
3-methylsulanylhexyl acetate
hmdb:HMDB0032427
VIQXICKUKPVFRK-UHFFFAOYSA-N 		(S)-3-Methylthiohexyl acetate
(S)-3-Methylthiohexyl acetic acid
1-Hexanol, 3-(methylthio)-, acetate
3-(Methylsulfanyl)hexyl acetate
3-(Methylsulfanyl)hexyl acetic acid
3-(Methylsulphanyl)hexyl acetate
3-(Methylsulphanyl)hexyl acetic acid
3-(methylsulfanyl)hexyl acetate
3-(methylthio)-1-Hexyl acetate
3-(methylthio)Hexyl acetate

hmdb:HMDB32427 		secondary/obsolete/fantasy identifier