| SpectraBase Compound ID | FFOpDLnCi1X |
|---|---|
| InChI | InChI=1S/C18H13F5O2/c19-17(20,18(21,22)23)16(24)25-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)15/h1-6,8-9,15H,7,10H2 |
| InChIKey | WFJGJUWXOWCVOI-UHFFFAOYSA-N |
| Mol Weight | 356.29 g/mol |
| Molecular Formula | C18H13F5O2 |
| Exact Mass | 356.08357 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4bcG76RF3G7 |
|---|---|
| Name | 4-(1-Indanyl)phenol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.083570472 u |
| Formula | C18H13F5O2 |
| InChI | InChI=1S/C18H13F5O2/c19-17(20,18(21,22)23)16(24)25-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)15/h1-6,8-9,15H,7,10H2 |
| InChIKey | WFJGJUWXOWCVOI-UHFFFAOYSA-N |
| Molecular Weight | 356.292 g/mol |
| SMILES | C1(OC(C(C(F)(F)F)(F)F)=O)=CC=C(C=C1)C1CCC2=C1C=CC=C2 |