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3-BENZYL-5-BENZYLAMINO-4-DIMETHYLAMINO-2-METHYLTHIO-THIAZOLIUM-CHLORIDE
SpectraBase Compound ID B0tHXiU4HIg
InChI InChI=1S/C20H24N3S2.ClH/c1-22(2)19-18(21-14-16-10-6-4-7-11-16)25-20(24-3)23(19)15-17-12-8-5-9-13-17;/h4-13,21H,14-15H2,1-3H3;1H/q+1;/p-1
InChIKey NHWSVJPMIRCOEK-UHFFFAOYSA-M
Mol Weight 406.01 g/mol
Molecular Formula C20H24ClN3S2
Exact Mass 405.110018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45ayP8O2Iaa
Name 3-BENZYL-5-BENZYLAMINO-4-DIMETHYLAMINO-2-METHYLTHIO-THIAZOLIUM-CHLORIDE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24ClN3S2
InChI InChI=1S/C20H24N3S2.ClH/c1-22(2)19-18(21-14-16-10-6-4-7-11-16)25-20(24-3)23(19)15-17-12-8-5-9-13-17;/h4-13,21H,14-15H2,1-3H3;1H/q+1;/p-1
InChIKey NHWSVJPMIRCOEK-UHFFFAOYSA-M
Literature Reference Author F.BERREE,Y.MALVAUT,E.MARCHAND,G.MOREL
Literature Reference Citation J.ORG.CHEM.,58,6022(1993)
Literature Reference DOI 10.1021/jo00074a032
Molecular Weight 406.004 g/mol
Solvent CDCl3
Source File Reference UWSP10186