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5-(TERT.-BUTYLAMINO)-4-(DIMETHYLAMINO)-3-[(ETHOXYCARBONYL)-METHYL]-2-(PHENYLTHIO)-THIAZOLIUM-CHLORIDE
SpectraBase Compound ID GGqC0vHRqWu
InChI InChI=1S/C19H28N3O2S2.ClH/c1-7-24-15(23)13-22-17(21(5)6)16(20-19(2,3)4)26-18(22)25-14-11-9-8-10-12-14;/h8-12,20H,7,13H2,1-6H3;1H/q+1;/p-1
InChIKey WNGGXLDGWHNCAF-UHFFFAOYSA-M
Mol Weight 430.03 g/mol
Molecular Formula C19H28ClN3O2S2
Exact Mass 429.131147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LlXuM4PZebA
Name 5-(TERT.-BUTYLAMINO)-4-(DIMETHYLAMINO)-3-[(ETHOXYCARBONYL)-METHYL]-2-(PHENYLTHIO)-THIAZOLIUM-CHLORIDE
Compound Number 6G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H28ClN3O2S2
InChI InChI=1S/C19H28N3O2S2.ClH/c1-7-24-15(23)13-22-17(21(5)6)16(20-19(2,3)4)26-18(22)25-14-11-9-8-10-12-14;/h8-12,20H,7,13H2,1-6H3;1H/q+1;/p-1
InChIKey WNGGXLDGWHNCAF-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 430.023 g/mol
Solvent CDCl3
Source File Reference UWSP10192