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

View entire compound with spectra: 6 NMR

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KSTKXvwezi
Name 4-PHENYL-5-(4-METHOXYPHENYL)-1,3,4-THIADIAZOLIUM-2-PHENYLAMINE-CHLORIDE
Compound Number 4B
Copyright Copyright © 2016-2025 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 M.A.M.MACIEL,A.ECHEVARRIA,V.M.RUMJANEK
Literature Reference Citation QUIM.NOVA,21,569(1998)
Literature Reference DOI 10.1590/s0100-40421998000500007
Molecular Weight 395.906 g/mol
Solvent DMSO-D6
Source File Reference UWBT12466