| SpectraBase Compound ID | 2ANlVtAKQ1N |
|---|---|
| InChI | InChI=1S/C14H15F5O2/c1-8-5-6-9(12(2,3)4)10(7-8)21-11(20)13(15,16)14(17,18)19/h5-7H,1-4H3 |
| InChIKey | VSZJPRXOVPGTNY-UHFFFAOYSA-N |
| Mol Weight | 310.26 g/mol |
| Molecular Formula | C14H15F5O2 |
| Exact Mass | 310.099221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DlVTEiRqLmq |
|---|---|
| Name | 2-Tert-butyl-5-methylphenol, o-pentafluoropropionyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.099220536 u |
| Formula | C14H15F5O2 |
| InChI | InChI=1S/C14H15F5O2/c1-8-5-6-9(12(2,3)4)10(7-8)21-11(20)13(15,16)14(17,18)19/h5-7H,1-4H3 |
| InChIKey | VSZJPRXOVPGTNY-UHFFFAOYSA-N |
| Molecular Weight | 310.264 g/mol |
| SMILES | C(C)(C)(C)C1=C(OC(C(C(F)(F)F)(F)F)=O)C=C(C=C1)C |