| SpectraBase Compound ID | Ip1VUx41hO7 |
|---|---|
| InChI | InChI=1S/C19H28F4O4/c1-2-3-4-5-6-7-8-9-10-11-14-26-16(24)12-13-17(25)27-15-19(22,23)18(20)21/h18H,2,5-15H2,1H3 |
| InChIKey | OTBVDCAYSZPAKL-UHFFFAOYSA-N |
| Mol Weight | 396.42 g/mol |
| Molecular Formula | C19H28F4O4 |
| Exact Mass | 396.192372 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EbQZgX67snw |
|---|---|
| Name | Succinic acid, 2,2,3,3-tetrafluoropropyl dodec-9-yn-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 396.192372030 u |
| Formula | C19H28F4O4 |
| InChI | InChI=1S/C19H28F4O4/c1-2-3-4-5-6-7-8-9-10-11-14-26-16(24)12-13-17(25)27-15-19(22,23)18(20)21/h18H,2,5-15H2,1H3 |
| InChIKey | OTBVDCAYSZPAKL-UHFFFAOYSA-N |
| Molecular Weight | 396.423 g/mol |
| SMILES | C(CC(OCC(C(F)F)(F)F)=O)C(OCCCCCCCCC#CCC)=O |