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N-(1,1,1-Trifluoro-3-(dodecanylsulfanyl)propan-2-yl)toluenesulfonamide
SpectraBase Compound ID 6RqVtxrvEEB
InChI InChI=1S/C22H36F3NO2S2/c1-3-4-5-6-7-8-9-10-11-12-17-29-18-21(22(23,24)25)26-30(27,28)20-15-13-19(2)14-16-20/h13-16,21,26H,3-12,17-18H2,1-2H3
InChIKey BHVLJYGHWCCTTE-UHFFFAOYSA-N
Mol Weight 467.7 g/mol
Molecular Formula C22H36F3NO2S2
Exact Mass 467.213956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxGuRmhVRsJ
Name N-(1,1,1-Trifluoro-3-(dodecanylsulfanyl)propan-2-yl)toluenesulfonamide
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Formula C22H36F3NO2S2
InChI InChI=1S/C22H36F3NO2S2/c1-3-4-5-6-7-8-9-10-11-12-17-29-18-21(22(23,24)25)26-30(27,28)20-15-13-19(2)14-16-20/h13-16,21,26H,3-12,17-18H2,1-2H3
InChIKey BHVLJYGHWCCTTE-UHFFFAOYSA-N
Molecular Weight 467.650 g/mol
SMILES N(S(=O)(=O)c1ccc(cc1)C)C(C(F)(F)F)CSCCCCCCCCCCCC
SPLASH splash10-02td-7982000000-93e36fc71a47cc9e4a48
Source of Spectrum Yui Takehiro, et al. Tetrahedron, V.69, 2013, P.7448-7454
Synonyms N-(3-(dodecylthio)-1,1,1-trifluoropropan-2-yl)-4-methylbenzenesulfonamide
Wiley ID 1817224