| SpectraBase Compound ID | 85NOvtbQ7Pq |
|---|---|
| InChI | InChI=1S/C10H8F5NO4/c11-9(12,10(13,14)15)5-20-7(17)4-16-8(18)6-2-1-3-19-6/h1-3H,4-5H2,(H,16,18) |
| InChIKey | BROJGNRTRLCVGL-UHFFFAOYSA-N |
| Mol Weight | 301.17 g/mol |
| Molecular Formula | C10H8F5NO4 |
| Exact Mass | 301.037349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IOeqyoz7DVZ |
|---|---|
| Name | N-(2-Furoyl)glycine, 2,2,3,3,3-pentafluoropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.037348553 u |
| Formula | C10H8F5NO4 |
| InChI | InChI=1S/C10H8F5NO4/c11-9(12,10(13,14)15)5-20-7(17)4-16-8(18)6-2-1-3-19-6/h1-3H,4-5H2,(H,16,18) |
| InChIKey | BROJGNRTRLCVGL-UHFFFAOYSA-N |
| Molecular Weight | 301.169 g/mol |
| SMILES | C=1OC(=CC1)C(=O)NCC(OCC(C(F)(F)F)(F)F)=O |