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3-(4-mesylphenyl)-1-phenyl-4-(trifluoromethyl)pyrazole
SpectraBase Compound ID BfI1Oaq6XWQ
InChI InChI=1S/C17H13F3N2O2S/c1-25(23,24)14-9-7-12(8-10-14)16-15(17(18,19)20)11-22(21-16)13-5-3-2-4-6-13/h2-11H,1H3
InChIKey MJVRDXWQENMLKQ-UHFFFAOYSA-N
Mol Weight 366.36 g/mol
Molecular Formula C17H13F3N2O2S
Exact Mass 366.064983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iqn4fzB9cmI
Name 3-(4-mesylphenyl)-1-phenyl-4-(trifluoromethyl)pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F3N2O2S
InChI InChI=1S/C17H13F3N2O2S/c1-25(23,24)14-9-7-12(8-10-14)16-15(17(18,19)20)11-22(21-16)13-5-3-2-4-6-13/h2-11H,1H3
InChIKey MJVRDXWQENMLKQ-UHFFFAOYSA-N
Molecular Weight 366.358 g/mol
SMILES c1(c(n[n](c1)-c1ccccc1)-c1ccc(S(=O)(=O)C)cc1)C(F)(F)F
SPLASH splash10-00p0-7259000000-139a4bbbcf20ce18a82a
Source of Spectrum Y-30-369-6
Synonyms 3-(4-Methylsulfonylphenyl)-1-phenyl-4-(trifluoromethyl)pyrazole
Wiley ID 1351742