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2-ANILINO-5-(4'-METHOXYPHENYL)-4-PHENYL-1,3,4-THIADIAZOLIUM-4-HYDROCHLORIDE

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2-ANILINO-5-(4'-METHOXYPHENYL)-4-PHENYL-1,3,4-THIADIAZOLIUM-4-HYDROCHLORIDE
SpectraBase Compound ID px0zIcdQ8Z
InChI InChI=1S/C21H18N3OS.ClH/c1-25-19-14-12-16(13-15-19)20-24(18-10-6-3-7-11-18)23-21(26-20)22-17-8-4-2-5-9-17;/h2-15H,1H3,(H,22,23);1H/q+1;/p-1
InChIKey GWGOAHVSOMINQU-UHFFFAOYSA-M
Mol Weight 395.91 g/mol
Molecular Formula C21H18ClN3OS
Exact Mass 395.085911 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 28Gtiu97sk0
Name 2-(4-METHOXYPHENYL)-3-PHENYL-5-PHENYLAMINO-1,3,4-TRIAZOLIUM_CHLORIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18ClN3OS
InChI InChI=1S/C21H18N3OS.ClH/c1-25-19-14-12-16(13-15-19)20-24(18-10-6-3-7-11-18)23-21(26-20)22-17-8-4-2-5-9-17;/h2-15H,1H3,(H,22,23);1H/q+1;/p-1
InChIKey GWGOAHVSOMINQU-UHFFFAOYSA-M
Literature Reference Author L.STEFANIAK,J.JAZWINSKI
Literature Reference Citation CHEM.HET.COMP.,31,1027(1995)
Literature Reference DOI 10.1007/bf01165049
Solvent DMSO-D6
Source File Reference UWMZ14894