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CHEBI:46040 - 1,1,1-TRIFLUORO-3-(OCTYLTHIO)ACETONE

Default Structure
ChEBI IDCHEBI:46040
ChEBI Name1,1,1-TRIFLUORO-3-(OCTYLTHIO)ACETONE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC11H19F3OS
Net Charge0
Average Mass256.333
Monoisotopic Mass256.11087
SMILES[H]C([H])(SC([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C(=O)C(F)(F)F
InChIInChI=1S/C11H19F3OS/c1-2-3-4-5-6-7-8-16-9-10(15)11(12,13)14/h2-9H2,1H3
InChIKeyWMQHRXUKAYSPPK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1,1,1-TRIFLUORO-3-(OCTYLTHIO)ACETONE (CHEBI:46040) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1,1,1-trifluoro-3-(octylsulfanyl)propan-2-onePDBeChem
1,1,1-TRIFLUORO-3-(OCTYLTHIO)ACETONEPDBeChem
Manual XrefsDatabases
TFCPDBeChem