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N-Methyl-N-(oxodiphenyl-lamda6-sulfaneylidene)methanaminium trifluoromethanesulfonate
SpectraBase Compound ID IYL2TCYvNmR
InChI InChI=1S/C14H16NOS.CHF3O3S/c1-15(2)17(16,13-9-5-3-6-10-13)14-11-7-4-8-12-14;2-1(3,4)8(5,6)7/h3-12H,1-2H3;(H,5,6,7)/q+1;/p-1
InChIKey CLVBCANFHGQFDW-UHFFFAOYSA-M
Mol Weight 395.41 g/mol
Molecular Formula C15H16F3NO4S2
Exact Mass 395.047285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TXYNZyShSg
Name N-Methyl-N-(oxodiphenyl-lamda6-sulfaneylidene)methanaminium trifluoromethanesulfonate
Appearance White solid
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Formula C15H16F3NO4S2
InChI InChI=1S/C14H16NOS.CHF3O3S/c1-15(2)17(16,13-9-5-3-6-10-13)14-11-7-4-8-12-14;2-1(3,4)8(5,6)7/h3-12H,1-2H3;(H,5,6,7)/q+1;/p-1
InChIKey CLVBCANFHGQFDW-UHFFFAOYSA-M
Instrument Name Finnigan SSQ Finnigan 7000
Ionization Type EI
Literature Reference DOI 10.1002/asia.202200828
Molecular Weight 395.411 g/mol
SMILES C(S([O-])(=O)=O)(F)(F)F.c1(S(c2ccccc2)(=[N+](C)C)=O)ccccc1
SPLASH splash10-0002-1090000000-c7954665e56015646aa6
Source of Spectrum CAJ-17-SM5-5a
Wiley ID 1876064