| SpectraBase Compound ID | DMiKPSJIS1i |
|---|---|
| InChI | InChI=1S/C13H15F3O3/c1-18-8-7-11(10-5-3-2-4-6-10)9-19-12(17)13(14,15)16/h2-6,11H,7-9H2,1H3 |
| InChIKey | YPPQJVPWGRQVLF-UHFFFAOYSA-N |
| Mol Weight | 276.26 g/mol |
| Molecular Formula | C13H15F3O3 |
| Exact Mass | 276.097329 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8kaXJaebVxy |
|---|---|
| Name | 1-Methoxy-3-phenyl-4-trifluoroacetyloxy-butane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.097328829 u |
| Formula | C13H15F3O3 |
| InChI | InChI=1S/C13H15F3O3/c1-18-8-7-11(10-5-3-2-4-6-10)9-19-12(17)13(14,15)16/h2-6,11H,7-9H2,1H3 |
| InChIKey | YPPQJVPWGRQVLF-UHFFFAOYSA-N |
| Molecular Weight | 276.255 g/mol |
| SMILES | COCCC(COC(C(F)(F)F)=O)C1=CC=CC=C1 |