| SpectraBase Compound ID | Lbh6cOOOBmT |
|---|---|
| InChI | InChI=1S/C16H21FO4/c1-3-12(2)10-11-20-15(18)8-9-16(19)21-14-7-5-4-6-13(14)17/h4-7,12H,3,8-11H2,1-2H3 |
| InChIKey | KWXVPIPOANHSCW-UHFFFAOYSA-N |
| Mol Weight | 296.34 g/mol |
| Molecular Formula | C16H21FO4 |
| Exact Mass | 296.142387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3TooeuoGbe8 |
|---|---|
| Name | Succinic acid, 2-fluorophenyl 3-methylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.142387315 u |
| Formula | C16H21FO4 |
| InChI | InChI=1S/C16H21FO4/c1-3-12(2)10-11-20-15(18)8-9-16(19)21-14-7-5-4-6-13(14)17/h4-7,12H,3,8-11H2,1-2H3 |
| InChIKey | KWXVPIPOANHSCW-UHFFFAOYSA-N |
| Molecular Weight | 296.338 g/mol |
| SMILES | C(CC(OC1=CC=CC=C1F)=O)C(OCCC(C)CC)=O |