| SpectraBase Compound ID | GoOHJF7VfW3 |
|---|---|
| InChI | InChI=1S/C14H15F3O2/c1-10(2)9-19-13(18)7-6-11-4-3-5-12(8-11)14(15,16)17/h3-8,10H,9H2,1-2H3/b7-6+ |
| InChIKey | UGNQCAFQKYEAAV-VOTSOKGWSA-N |
| Mol Weight | 272.27 g/mol |
| Molecular Formula | C14H15F3O2 |
| Exact Mass | 272.102414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1EG2O08MFiU |
|---|---|
| Name | 3-Trifluoromethylcinnamic acid, 2-methylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.102414210 u |
| Formula | C14H15F3O2 |
| InChI | InChI=1S/C14H15F3O2/c1-10(2)9-19-13(18)7-6-11-4-3-5-12(8-11)14(15,16)17/h3-8,10H,9H2,1-2H3/b7-6+ |
| InChIKey | UGNQCAFQKYEAAV-VOTSOKGWSA-N |
| Molecular Weight | 272.267 g/mol |
| SMILES | C(OC(\C=C\C=1C=CC=C(C(F)(F)F)C1)=O)C(C)C |