| SpectraBase Compound ID | Fqts5rkjmJQ |
|---|---|
| InChI | InChI=1S/C12H13F3O2/c1-8(2)11(16)17-10(12(13,14)15)9-6-4-3-5-7-9/h3-8,10H,1-2H3 |
| InChIKey | CUNNCDMWQUXDHP-UHFFFAOYSA-N |
| Mol Weight | 246.23 g/mol |
| Molecular Formula | C12H13F3O2 |
| Exact Mass | 246.086764 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2PkBfpCo3Tm |
|---|---|
| Name | Isobutyric acid, 1-phenyl-2,2,2-trifluoroethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13F3O2 |
| InChI | InChI=1S/C12H13F3O2/c1-8(2)11(16)17-10(12(13,14)15)9-6-4-3-5-7-9/h3-8,10H,1-2H3 |
| InChIKey | CUNNCDMWQUXDHP-UHFFFAOYSA-N |
| Molecular Weight | 246.229 g/mol |
| SMILES | CC(C)C(OC(C(F)(F)F)c1ccccc1)=O |
| SPLASH | splash10-05fu-9310000000-f1e9c5b4b9b8fae413b5 |
| Source of Spectrum | TIPS-2023-23-0 |
| Wiley ID | 1884731 |