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CHEBI:92339 - 4,4,4-trifluoro-1-butanesulfonic acid

ChEBI IDCHEBI:92339
ChEBI Name4,4,4-trifluoro-1-butanesulfonic acid
Stars
DownloadsMolfile
FormulaC18H13F6NO4S
Net Charge0
Average Mass453.360
Monoisotopic Mass453.04695
SMILESN#Cc1c(Oc2cccc(OS(=O)(=O)CCCC(F)(F)F)c2)cccc1C(F)(F)F
InChIInChI=1S/C18H13F6NO4S/c19-17(20,21)8-3-9-30(26,27)29-13-5-1-4-12(10-13)28-16-7-2-6-15(14(16)11-25)18(22,23)24/h1-2,4-7,10H,3,8-9H2
InChIKeyLWUSZIVDPJPVBW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4,4,4-trifluoro-1-butanesulfonic acid (CHEBI:92339) is a aromatic ether (CHEBI:35618)
Manual XrefsDatabases
LSM-2414LINCS