![3,3-dimethyl-1-[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]-2-butanone](/api/spectrum/Ec6a5mKYHBv/structure.png?h=300&w=458 "3,3-dimethyl-1-[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]-2-butanone")
| SpectraBase Compound ID | 5E0Dhk4Gwrm |
|---|---|
| InChI | InChI=1S/C14H15F3N4O/c1-13(2,3)11(22)8-21-19-12(18-20-21)9-5-4-6-10(7-9)14(15,16)17/h4-7H,8H2,1-3H3 |
| InChIKey | PQPBMRWVDBIROL-UHFFFAOYSA-N |
| Mol Weight | 312.3 g/mol |
| Molecular Formula | C14H15F3N4O |
| Exact Mass | 312.119796 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ec6a5mKYHBv |
|---|---|
| Name | 3,3-dimethyl-1-[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]-2-butanone |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H15F3N4O |
| InChI | InChI=1S/C14H15F3N4O/c1-13(2,3)11(22)8-21-19-12(18-20-21)9-5-4-6-10(7-9)14(15,16)17/h4-7H,8H2,1-3H3 |
| InChIKey | PQPBMRWVDBIROL-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58516M |
| Solvent | CDCl3 |