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4-BENZOYL-5-METHYL-1-[2-(2-THIENYL)-4-TRIFLUOROMETHYL-5-THIAZOLYL]-TRIAZOLE

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4-BENZOYL-5-METHYL-1-[2-(2-THIENYL)-4-TRIFLUOROMETHYL-5-THIAZOLYL]-TRIAZOLE
SpectraBase Compound ID ExDEq3MhVGE
InChI InChI=1S/C18H11F3N4OS2/c1-10-13(14(26)11-6-3-2-4-7-11)23-24-25(10)17-15(18(19,20)21)22-16(28-17)12-8-5-9-27-12/h2-9H,1H3
InChIKey NMDNWPWEPKHJSL-UHFFFAOYSA-N
Mol Weight 420.43 g/mol
Molecular Formula C18H11F3N4OS2
Exact Mass 420.032638 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1zUugHLtJJw
Name 4-BENZOYL-5-METHYL-1-[2-(2-THIENYL)-4-TRIFLUOROMETHYL-5-THIAZOLYL]-TRIAZOLE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H11F3N4OS2
InChI InChI=1S/C18H11F3N4OS2/c1-10-13(14(26)11-6-3-2-4-7-11)23-24-25(10)17-15(18(19,20)21)22-16(28-17)12-8-5-9-27-12/h2-9H,1H3
InChIKey NMDNWPWEPKHJSL-UHFFFAOYSA-N
Literature Reference Author K.BURGER,E.HOESS,N.SEWALD,K.GEITH,J.RIEDE,P.BISSINGER
Literature Reference Citation Z.NATURFORSCH.,45B,1695(1990)
Solvent CDCl3
Source File Reference UWCS13134