| SpectraBase Compound ID | AkkJcBNUqDG |
|---|---|
| InChI | InChI=1S/C17H21F5O2/c1-14(2,3)10-8-7-9-11(15(4,5)6)12(10)24-13(23)16(18,19)17(20,21)22/h7-9H,1-6H3 |
| InChIKey | HJUQLLLFGQNGSZ-UHFFFAOYSA-N |
| Mol Weight | 352.35 g/mol |
| Molecular Formula | C17H21F5O2 |
| Exact Mass | 352.146171 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7wADU2z7e2q |
|---|---|
| Name | 2,6-di-Tert-butylphenol, o-pentafluoropropionyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.146170729 u |
| Formula | C17H21F5O2 |
| InChI | InChI=1S/C17H21F5O2/c1-14(2,3)10-8-7-9-11(15(4,5)6)12(10)24-13(23)16(18,19)17(20,21)22/h7-9H,1-6H3 |
| InChIKey | HJUQLLLFGQNGSZ-UHFFFAOYSA-N |
| Molecular Weight | 352.345 g/mol |
| SMILES | C(C)(C)(C)C1=C(OC(C(C(F)(F)F)(F)F)=O)C(C(C)(C)C)=CC=C1 |