| SpectraBase Compound ID | DTtLKGbHwJY |
|---|---|
| InChI | InChI=1S/C14H10F3NO3/c1-9-4-2-3-5-12(9)21-13-7-6-10(14(15,16)17)8-11(13)18(19)20/h2-8H,1H3 |
| InChIKey | ZHZWURKSBGZLCJ-UHFFFAOYSA-N |
| Mol Weight | 297.23 g/mol |
| Molecular Formula | C14H10F3NO3 |
| Exact Mass | 297.061278 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HTOuQmLYcav |
|---|---|
| Name | 2-Nitro-alpha,alpha,alpha-trifluoro-p-tolyl o-tolyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.061277672 u |
| Formula | C14H10F3NO3 |
| InChI | InChI=1S/C14H10F3NO3/c1-9-4-2-3-5-12(9)21-13-7-6-10(14(15,16)17)8-11(13)18(19)20/h2-8H,1H3 |
| InChIKey | ZHZWURKSBGZLCJ-UHFFFAOYSA-N |
| Molecular Weight | 297.233 g/mol |
| SMILES | C(F)(F)(F)C=1C=C(C(=CC1)OC=1C=CC=CC1C)N(=O)=O |