SpectraBase Spectrum ID |
4gKA7mT70kX |
Name |
N-[(4-Cyanophenyl)(oxo)(phenyl)-lamda6-sulfaneylidene]-N-methylmethanaminium trifluoromethanesulfonate |
Appearance |
White solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H15F3N2O4S2 |
InChI |
InChI=1S/C15H15N2OS.CHF3O3S/c1-17(2)19(18,14-6-4-3-5-7-14)15-10-8-13(12-16)9-11-15;2-1(3,4)8(5,6)7/h3-11H,1-2H3;(H,5,6,7)/q+1;/p-1 |
InChIKey |
ZSQIRZDKECAJRA-UHFFFAOYSA-M |
Instrument Name |
Finnigan SSQ Finnigan 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/asia.202200828 |
Molecular Weight |
420.421 g/mol |
SMILES |
C(S([O-])(=O)=O)(F)(F)F.c1(S(=O)(c2ccccc2)=[N+](C)C)ccc(cc1)C#N |
SPLASH |
splash10-001r-9010000000-50bb0861a68ff9545f2f |
Source of Spectrum |
CAJ-17-SM7-5i |
Wiley ID |
1876072 |