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(1R,2R)-(+)-1,2-(3,3',5,5'-Tetrafluoro-2,2'-dihydroxydibenzenesulfonamido)cyclohexane
SpectraBase Compound ID 8ItJAX01Zzj
InChI InChI=1S/C18H18F4N2O6S2/c19-9-5-11(21)17(25)15(7-9)31(27,28)23-13-3-1-2-4-14(13)24-32(29,30)16-8-10(20)6-12(22)18(16)26/h5-8,13-14,23-26H,1-4H2/t13-,14-/m1/s1
InChIKey UUKKOSAZWALCDU-ZIAGYGMSSA-N
Mol Weight 498.46 g/mol
Molecular Formula C18H18F4N2O6S2
Exact Mass 498.054241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BG2Wk3Czrbh
Name (1R,2R)-(+)-1,2-(3,3',5,5'-Tetrafluoro-2,2'-dihydroxydibenzenesulfonamido)cyclohexane
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Formula C18H18F4N2O6S2
InChI InChI=1S/C18H18F4N2O6S2/c19-9-5-11(21)17(25)15(7-9)31(27,28)23-13-3-1-2-4-14(13)24-32(29,30)16-8-10(20)6-12(22)18(16)26/h5-8,13-14,23-26H,1-4H2/t13-,14-/m1/s1
InChIKey UUKKOSAZWALCDU-ZIAGYGMSSA-N
Molecular Weight 498.464 g/mol
SMILES Oc1c(S(N[C@]2([C@](NS(c3c(c(cc(c3)F)F)O)(=O)=O)(CCCC2)[H])[H])(=O)=O)cc(cc1F)F
SPLASH splash10-0a4j-2009300000-d4b9ef0022993599f785
Source of Spectrum F-53-4153-3
Synonyms N-((1R,2R)-2-{[(3,5-difluoro-2-hydroxyphenyl)sulfonyl]amino}cyclohexyl)-3,5-difluoro-2-hydroxybenzenesulfonamide
Wiley ID 801281