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2,4-Diphenyl-6-pyrrolidino-1,3-thiazinium-perchlorate
SpectraBase Compound ID D5ze3C3XQZ3
InChI InChI=1S/C20H19N2S.ClHO4/c1-3-9-16(10-4-1)18-15-19(22-13-7-8-14-22)23-20(21-18)17-11-5-2-6-12-17;2-1(3,4)5/h1-6,9-12,15H,7-8,13-14H2;(H,2,3,4,5)/q+1;/p-1
InChIKey GIHBLWJURQNHAJ-UHFFFAOYSA-M
Mol Weight 418.9 g/mol
Molecular Formula C20H19ClN2O4S
Exact Mass 418.075406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNUkyOg49eM
Name 2,4-Diphenyl-6-pyrrolidino-1,3-thiazinium-perchlorate
Alternate Name(s) 2,4-Diphenyl-6-(1-pyrrolidinyl)-1,3-thiazin-1-ium perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19ClN2O4S
InChI InChI=1S/C20H19N2S.ClHO4/c1-3-9-16(10-4-1)18-15-19(22-13-7-8-14-22)23-20(21-18)17-11-5-2-6-12-17;2-1(3,4)5/h1-6,9-12,15H,7-8,13-14H2;(H,2,3,4,5)/q+1;/p-1
InChIKey GIHBLWJURQNHAJ-UHFFFAOYSA-M
Molecular Weight 418.895 g/mol
SMILES [Cl]([O-])(=O)(=O)=O.c1([s+]c(nc(c1)-c1ccccc1)-c1ccccc1)N1CCCC1
SPLASH splash10-0a4i-0900000000-474b5722228fa119dfce
Source of Spectrum AH-118-1391-3
Wiley ID 1377061