| SpectraBase Compound ID | HoPbumKMFQr |
|---|---|
| InChI | InChI=1S/C20H25F5O4/c1-2-3-4-5-6-7-8-12-28-13(26)10-9-11-14(27)29-20-18(24)16(22)15(21)17(23)19(20)25/h2-12H2,1H3 |
| InChIKey | BLWLPGDUDMOQDF-UHFFFAOYSA-N |
| Mol Weight | 424.41 g/mol |
| Molecular Formula | C20H25F5O4 |
| Exact Mass | 424.1673 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ajd0YwCS64G |
|---|---|
| Name | Glutaric acid, nonyl pentafluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 424.167300096 u |
| Formula | C20H25F5O4 |
| InChI | InChI=1S/C20H25F5O4/c1-2-3-4-5-6-7-8-12-28-13(26)10-9-11-14(27)29-20-18(24)16(22)15(21)17(23)19(20)25/h2-12H2,1H3 |
| InChIKey | BLWLPGDUDMOQDF-UHFFFAOYSA-N |
| Molecular Weight | 424.408 g/mol |
| SMILES | CCCCCCCCCOC(CCCC(OC1=C(C(=C(C(=C1F)F)F)F)F)=O)=O |