| SpectraBase Compound ID | ACX8LeAakrI |
|---|---|
| InChI | InChI=1S/C19H21FO2/c1-13(18(21)22-19(2,3)4)15-10-11-16(17(20)12-15)14-8-6-5-7-9-14/h5-13H,1-4H3 |
| InChIKey | JPOAUYHZGGGXHU-UHFFFAOYSA-N |
| Mol Weight | 300.37 g/mol |
| Molecular Formula | C19H21FO2 |
| Exact Mass | 300.152558 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IAWmE1LQWFH |
|---|---|
| Name | Tert.-butyl-alpha-(3-fluoro-4-biphenyl)-propionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.152558077 u |
| Formula | C19H21FO2 |
| InChI | InChI=1S/C19H21FO2/c1-13(18(21)22-19(2,3)4)15-10-11-16(17(20)12-15)14-8-6-5-7-9-14/h5-13H,1-4H3 |
| InChIKey | JPOAUYHZGGGXHU-UHFFFAOYSA-N |
| Molecular Weight | 300.373 g/mol |
| SMILES | C=1(F)C=C(C(C)C(=O)OC(C)(C)C)C=CC1C1=CC=CC=C1 |