For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-[(4-Cyanophenyl)(oxo)(phenyl)-lamda6-sulfaneylidene]-N-methylmethanaminium trifluoromethanesulfonate
SpectraBase Compound ID JL0mbokDrTO
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
Mol Weight 420.42 g/mol
Molecular Formula C16H15F3N2O4S2
Exact Mass 420.042534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

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