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2-Methoxy-5-({[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
SpectraBase Compound ID 5seSA4rHUC9
InChI InChI=1S/C11H9F3N4O2S/c1-20-8-3-2-6(4-7(8)19)5-15-18-9(11(12,13)14)16-17-10(18)21/h2-5,19H,1H3,(H,17,21)/b15-5+
InChIKey ZIYNKKNAQUMLPF-PJQLUOCWSA-N
Mol Weight 318.27 g/mol
Molecular Formula C11H9F3N4O2S
Exact Mass 318.039831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HNg08vBfje9
Name 2-Methoxy-5-({[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
Alternate Name(s) 4-[(E)-(3-hydroxy-4-methoxy-benzylidene)amino]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione 4-[(E)-(3-hydroxy-4-methoxy-phenyl)methyleneamino]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione 4-[(E)-(3-hydroxy-4-methoxyphenyl)methylideneamino]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione 4-[(E)-(4-methoxy-3-oxidanyl-phenyl)methylideneamino]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione
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Formula C11H9F3N4O2S
InChI InChI=1S/C11H9F3N4O2S/c1-20-8-3-2-6(4-7(8)19)5-15-18-9(11(12,13)14)16-17-10(18)21/h2-5,19H,1H3,(H,17,21)/b15-5+
InChIKey ZIYNKKNAQUMLPF-PJQLUOCWSA-N
Molecular Weight 318.274 g/mol
SMILES Oc1cc(\C=N\[n]2c(nnc2C(F)(F)F)S)ccc1OC
SPLASH splash10-0002-1900000000-49affb4489aeb980aaab
Wiley ID 1452701