SpectraBase Compound ID | GIV6M044Pq3 |
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InChI | InChI=1S/C17H11ClF2N2OS2/c1-24-16-15(14(21-22-16)9-5-7-10(18)8-6-9)25-17(23)13-11(19)3-2-4-12(13)20/h2-8H,1H3,(H,21,22) |
InChIKey | QBQSMHSWXVSKEI-UHFFFAOYSA-N |
Mol Weight | 396.86 g/mol |
Molecular Formula | C17H11ClF2N2OS2 |
Exact Mass | 395.996939 g/mol |
SpectraBase Spectrum ID | An1S2TNomPG |
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Name | 3-(p-chlorophenyl)-5-(methylthio)pyrazole-4-thiol, 2,6-difluorobenzoate (ester) |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C17H11ClF2N2OS2 |
InChI | InChI=1S/C17H11ClF2N2OS2/c1-24-16-15(14(21-22-16)9-5-7-10(18)8-6-9)25-17(23)13-11(19)3-2-4-12(13)20/h2-8H,1H3,(H,21,22) |
InChIKey | QBQSMHSWXVSKEI-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 58770M |
Solvent | Polysol |