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5-[(2,6-DIMETHYLPHENYL)-AMINO]-4-(DIMETHYLAMINO)-2-(METHYLTHIO)-3-ISOPROPYLTHIAZOLIUM-CHLORIDE
SpectraBase Compound ID KEeqOxOZnoL
InChI InChI=1S/C17H26N3S2.ClH/c1-11(2)20-16(19(5)6)15(22-17(20)21-7)18-14-12(3)9-8-10-13(14)4;/h8-11,18H,1-7H3;1H/q+1;/p-1
InChIKey QTTIJSKJVVFDCW-UHFFFAOYSA-M
Mol Weight 371.99 g/mol
Molecular Formula C17H26ClN3S2
Exact Mass 371.125668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ExTInL2qQ7J
Name 5-[(2,6-DIMETHYLPHENYL)-AMINO]-4-(DIMETHYLAMINO)-2-(METHYLTHIO)-3-ISOPROPYLTHIAZOLIUM-CHLORIDE
Compound Number 6 K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H26ClN3S2
InChI InChI=1S/C17H26N3S2.ClH/c1-11(2)20-16(19(5)6)15(22-17(20)21-7)18-14-12(3)9-8-10-13(14)4;/h8-11,18H,1-7H3;1H/q+1;/p-1
InChIKey QTTIJSKJVVFDCW-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 371.987 g/mol
Solvent CDCl3
Source File Reference UWSP10194