| SpectraBase Compound ID | Kasrnl4ny0X |
|---|---|
| InChI | InChI=1S/C18H23FO4/c1-3-5-6-9-14(4-2)22-17(20)12-13-18(21)23-16-11-8-7-10-15(16)19/h4,7-8,10-11,14H,2-3,5-6,9,12-13H2,1H3 |
| InChIKey | NMCVKQSXAYZNJX-UHFFFAOYSA-N |
| Mol Weight | 322.38 g/mol |
| Molecular Formula | C18H23FO4 |
| Exact Mass | 322.158037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9V2mTpyKrdy |
|---|---|
| Name | Succinic acid, 2-fluorophenyl oct-1-en-3-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.158037380 u |
| Formula | C18H23FO4 |
| InChI | InChI=1S/C18H23FO4/c1-3-5-6-9-14(4-2)22-17(20)12-13-18(21)23-16-11-8-7-10-15(16)19/h4,7-8,10-11,14H,2-3,5-6,9,12-13H2,1H3 |
| InChIKey | NMCVKQSXAYZNJX-UHFFFAOYSA-N |
| Molecular Weight | 322.376 g/mol |
| SMILES | C(CC(OC1=CC=CC=C1F)=O)C(OC(CCCCC)C=C)=O |