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CHEBI:172334 - C10-LAS (TENTATIVE)

ChEBI IDCHEBI:172334
ChEBI NameC10-LAS (TENTATIVE)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26O3S
Net Charge0
Average Mass298.448
Monoisotopic Mass298.16027
SMILESCCCCCCC(CCC)c1ccc(S(=O)(=O)O)cc1
InChIInChI=1S/C16H26O3S/c1-3-5-6-7-9-14(8-4-2)15-10-12-16(13-11-15)20(17,18)19/h10-14H,3-9H2,1-2H3,(H,17,18,19)
InChIKeyNANHIUZYPFDGJS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
C10-LAS (TENTATIVE) (CHEBI:172334) is a organosulfur compound (CHEBI:33261)
C10-LAS (TENTATIVE) (CHEBI:172334) is a sulfonic acid derivative (CHEBI:33552)
IUPAC Name 
4-decan-4-ylbenzenesulonic acid
Manual XrefsDatabases
34501328ChemSpider