| SpectraBase Compound ID | KJhSjjfVnL8 |
|---|---|
| InChI | InChI=1S/C16H11F9N2O9/c1-4-2-27(13(32)26-8(4)28)9-7(36-12(31)16(23,24)25)6(35-11(30)15(20,21)22)5(34-9)3-33-10(29)14(17,18)19/h2,5-7,9H,3H2,1H3,(H,26,28,32) |
| InChIKey | FDCYXEIHTGKUSP-UHFFFAOYSA-N |
| Mol Weight | 546.25 g/mol |
| Molecular Formula | C16H11F9N2O9 |
| Exact Mass | 546.032083 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JNeMsTROSXn |
|---|---|
| Name | 5-Methyluridine, tris(trifluoroacetate) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 546.032083400 u |
| Formula | C16H11F9N2O9 |
| InChI | InChI=1S/C16H11F9N2O9/c1-4-2-27(13(32)26-8(4)28)9-7(36-12(31)16(23,24)25)6(35-11(30)15(20,21)22)5(34-9)3-33-10(29)14(17,18)19/h2,5-7,9H,3H2,1H3,(H,26,28,32) |
| InChIKey | FDCYXEIHTGKUSP-UHFFFAOYSA-N |
| Molecular Weight | 546.255 g/mol |
| SMILES | C1(OC(C(F)(F)F)=O)C(OC(C1OC(C(F)(F)F)=O)COC(C(F)(F)F)=O)N1C(=O)NC(C(=C1)C)=O |