| SpectraBase Compound ID | LWQUrBCMP3p |
|---|---|
| InChI | InChI=1S/C4H7F3O/c1-2-8-3-4(5,6)7/h2-3H2,1H3 |
| InChIKey | ZKNHDJMXIUOHLX-UHFFFAOYSA-N |
| Mol Weight | 128.09 g/mol |
| Molecular Formula | C4H7F3O |
| Exact Mass | 128.044899 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2rKNSpTZK3x |
|---|---|
| Name | 1,1,1-Trifluoro-3-oxapentane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 128.044899333 u |
| Formula | C4H7F3O |
| InChI | InChI=1S/C4H7F3O/c1-2-8-3-4(5,6)7/h2-3H2,1H3 |
| InChIKey | ZKNHDJMXIUOHLX-UHFFFAOYSA-N |
| Molecular Weight | 128.094 g/mol |
| SMILES | C(OCC)C(F)(F)F |