CHEBI:196234 - 2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanone

ChEBI IDCHEBI:196234
ChEBI Name2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanone
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SubmitterMetaboLights
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FormulaC14H22O2S
Net Charge0
Average Mass254.395
Monoisotopic Mass254.13405
SMILESCc1occc1SC(C(=O)CC(C)C)C(C)C
InChIInChI=1S/C14H22O2S/c1-9(2)8-12(15)14(10(3)4)17-13-6-7-16-11(13)5/h6-7,9-10,14H,8H2,1-5H3
InChIKeyPFFLSEMCPNTWOY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanone (CHEBI:196234) is a aryl sulfide (CHEBI:35683)
IUPAC Name 
2,6-dimethyl-3-(2-methyluran-3-yl)sulanylheptan-4-one
Manual XrefsDatabases
HMDB0037154HMDB
56003ChemSpider