| SpectraBase Compound ID | 6HrrKYt1N9c |
|---|---|
| InChI | InChI=1S/C19H26F2O4/c1-3-4-5-6-7-13-24-17(22)11-12-18(23)25-14(2)19-15(20)9-8-10-16(19)21/h8-10,14H,3-7,11-13H2,1-2H3 |
| InChIKey | SSGKYFPDODDFKC-UHFFFAOYSA-N |
| Mol Weight | 356.41 g/mol |
| Molecular Formula | C19H26F2O4 |
| Exact Mass | 356.179916 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jik9PSheZWV |
|---|---|
| Name | Succinic acid, 1-(2,6-difluorophenyl)ethyl heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.179915639 u |
| Formula | C19H26F2O4 |
| InChI | InChI=1S/C19H26F2O4/c1-3-4-5-6-7-13-24-17(22)11-12-18(23)25-14(2)19-15(20)9-8-10-16(19)21/h8-10,14H,3-7,11-13H2,1-2H3 |
| InChIKey | SSGKYFPDODDFKC-UHFFFAOYSA-N |
| Molecular Weight | 356.410 g/mol |
| SMILES | C(CCC(OC(C1=C(C=CC=C1F)F)C)=O)(OCCCCCCC)=O |