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5-(TERT.-BUTYLAMINO)-3-(2,6-DIMETHYLPHENYL)-2-[(4-METHYLPHENYL)-OXY]-4-PHENYLTHIAZOLIUM-CHLORIDE
SpectraBase Compound ID J0INcdj5unU
InChI InChI=1S/C28H31N2OS.ClH/c1-19-15-17-23(18-16-19)31-27-30(24-20(2)11-10-12-21(24)3)25(22-13-8-7-9-14-22)26(32-27)29-28(4,5)6;/h7-18,29H,1-6H3;1H/q+1;/p-1
InChIKey AQTCOTYIPIAMFB-UHFFFAOYSA-M
Mol Weight 479.08 g/mol
Molecular Formula C28H31ClN2OS
Exact Mass 478.184562 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9LZ5Gp5DJg1
Name 5-(TERT.-BUTYLAMINO)-3-(2,6-DIMETHYLPHENYL)-2-[(4-METHYLPHENYL)-OXY]-4-PHENYLTHIAZOLIUM-CHLORIDE
Compound Number 16C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H31ClN2OS
InChI InChI=1S/C28H31N2OS.ClH/c1-19-15-17-23(18-16-19)31-27-30(24-20(2)11-10-12-21(24)3)25(22-13-8-7-9-14-22)26(32-27)29-28(4,5)6;/h7-18,29H,1-6H3;1H/q+1;/p-1
InChIKey AQTCOTYIPIAMFB-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 479.080 g/mol
Solvent CDCl3
Source File Reference UWSP10200