![3-methyl-4-(2-methylallyl)-1-[(2,4,5-trichlorophenyl)sulfonyl]pyrazol-5-ol](/api/spectrum/3h87xRA3oUg/structure.png?h=300&w=458 "3-methyl-4-(2-methylallyl)-1-[(2,4,5-trichlorophenyl)sulfonyl]pyrazol-5-ol")
| SpectraBase Compound ID | KECUS3iXIcr |
|---|---|
| InChI | InChI=1S/C14H13Cl3N2O3S/c1-7(2)4-9-8(3)18-19(14(9)20)23(21,22)13-6-11(16)10(15)5-12(13)17/h5-6,20H,1,4H2,2-3H3 |
| InChIKey | KCKCLPGDSPHABE-UHFFFAOYSA-N |
| Mol Weight | 395.69 g/mol |
| Molecular Formula | C14H13Cl3N2O3S |
| Exact Mass | 393.971247 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3h87xRA3oUg |
|---|---|
| Name | 3-methyl-4-(2-methylallyl)-1-[(2,4,5-trichlorophenyl)sulfonyl]pyrazol-5-ol |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H13Cl3N2O3S |
| InChI | InChI=1S/C14H13Cl3N2O3S/c1-7(2)4-9-8(3)18-19(14(9)20)23(21,22)13-6-11(16)10(15)5-12(13)17/h5-6,20H,1,4H2,2-3H3 |
| InChIKey | KCKCLPGDSPHABE-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48843M |
| Solvent | CDCl3 |