| SpectraBase Compound ID | 8MTeRq93s9W |
|---|---|
| InChI | InChI=1S/C12H22N2O3S/c1-4-5-6-7-8-9-11-10(2)13-14(12(11)15)18(3,16)17/h15H,4-9H2,1-3H3 |
| InChIKey | PJXNITVKACUHBF-UHFFFAOYSA-N |
| Mol Weight | 274.38 g/mol |
| Molecular Formula | C12H22N2O3S |
| Exact Mass | 274.135114 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GXYQMSZ4R1i |
|---|---|
| Name | 4-heptyl-3-methyl-1-(methylsulfonyl)pyrazol-5-ol |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H22N2O3S |
| InChI | InChI=1S/C12H22N2O3S/c1-4-5-6-7-8-9-11-10(2)13-14(12(11)15)18(3,16)17/h15H,4-9H2,1-3H3 |
| InChIKey | PJXNITVKACUHBF-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56641M |
| Solvent | CDCl3 |