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3-{{{2-{[p-(1,3-dithiolan-2-yl)phenoxy]methyl}-4-thiazolyl}methyl}thio-4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazole

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3-{{{2-{[p-(1,3-dithiolan-2-yl)phenoxy]methyl}-4-thiazolyl}methyl}thio-4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazole
SpectraBase Compound ID 9mTKZeN0s3
InChI InChI=1S/C18H17F3N4OS4/c1-25-16(18(19,20)21)23-24-17(25)30-10-12-9-29-14(22-12)8-26-13-4-2-11(3-5-13)15-27-6-7-28-15/h2-5,9,15H,6-8,10H2,1H3
InChIKey HRTLUKFYEIYXTQ-UHFFFAOYSA-N
Mol Weight 490.6 g/mol
Molecular Formula C18H17F3N4OS4
Exact Mass 490.02373 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ByPJtlaJ9h
Name 3-{{{2-{[p-(1,3-dithiolan-2-yl)phenoxy]methyl}-4-thiazolyl}methyl}thio-4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazole
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17F3N4OS4
InChI InChI=1S/C18H17F3N4OS4/c1-25-16(18(19,20)21)23-24-17(25)30-10-12-9-29-14(22-12)8-26-13-4-2-11(3-5-13)15-27-6-7-28-15/h2-5,9,15H,6-8,10H2,1H3
InChIKey HRTLUKFYEIYXTQ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 59977M
Solvent CDCl3