![4-(o-fluorophenyl)-3-thio-1-{[5-(alpha,alpha,alpha-trifluoro-o-tolyl)-2H-tetrazol-2-yl]acetyl}semicarbazide](/api/spectrum/9GPWaSsUzdJ/structure.png?h=300&w=458 "4-(o-fluorophenyl)-3-thio-1-{[5-(alpha,alpha,alpha-trifluoro-o-tolyl)-2H-tetrazol-2-yl]acetyl}semicarbazide")
| SpectraBase Compound ID | H6sQO9cEGVa |
|---|---|
| InChI | InChI=1S/C17H13F4N7OS/c18-12-7-3-4-8-13(12)22-16(30)25-23-14(29)9-28-26-15(24-27-28)10-5-1-2-6-11(10)17(19,20)21/h1-8H,9H2,(H,23,29)(H2,22,25,30) |
| InChIKey | CPAUBSPBRJTFBV-UHFFFAOYSA-N |
| Mol Weight | 439.39 g/mol |
| Molecular Formula | C17H13F4N7OS |
| Exact Mass | 439.083842 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9GPWaSsUzdJ |
|---|---|
| Name | 4-(o-fluorophenyl)-3-thio-1-{[5-(alpha,alpha,alpha-trifluoro-o-tolyl)-2H-tetrazol-2-yl]acetyl}semicarbazide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H13F4N7OS |
| InChI | InChI=1S/C17H13F4N7OS/c18-12-7-3-4-8-13(12)22-16(30)25-23-14(29)9-28-26-15(24-27-28)10-5-1-2-6-11(10)17(19,20)21/h1-8H,9H2,(H,23,29)(H2,22,25,30) |
| InChIKey | CPAUBSPBRJTFBV-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 46890M |
| Solvent | DMSO-d6 |