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(5-tert-butylsulfanyl-2-nitro-phenyl) tris(fluoranyl)methanesulfonate
SpectraBase Compound ID K9jN998QMdM
InChI InChI=1S/C11H12F3NO5S2/c1-10(2,3)21-7-4-5-8(15(16)17)9(6-7)20-22(18,19)11(12,13)14/h4-6H,1-3H3
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Mol Weight 359.33 g/mol
Molecular Formula C11H12F3NO5S2
Exact Mass 359.010899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ibwpQJvrpY
Name (5-tert-butylsulfanyl-2-nitro-phenyl) tris(fluoranyl)methanesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C11H12F3NO5S2
InChI InChI=1S/C11H12F3NO5S2/c1-10(2,3)21-7-4-5-8(15(16)17)9(6-7)20-22(18,19)11(12,13)14/h4-6H,1-3H3
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Molecular Weight 359.334 g/mol
SMILES C(S(=O)(=O)Oc1c(ccc(c1)SC(C)(C)C)N(=O)=O)(F)(F)F
SPLASH splash10-0a4i-9000000000-90df00b99fa6e9bdf4f8
Source of Spectrum K1-0-3819-7
Synonyms trifluoromethanesulfonic acid [5-(tert-butylthio)-2-nitrophenyl] ester (5-tert-butylsulfanyl-2-nitrophenyl) trifluoromethanesulfonate (5-tert-butylsulfanyl-2-nitro-phenyl) trifluoromethanesulfonate
Wiley ID 1589352