SpectraBase Spectrum ID |
7ibwpQJvrpY |
Name |
(5-tert-butylsulfanyl-2-nitro-phenyl) tris(fluoranyl)methanesulfonate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
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 |
InChIKey |
ZQFMNJWLRQBUCI-UHFFFAOYSA-N |
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 |