| SpectraBase Compound ID | 9LrtYn7gFkt |
|---|---|
| InChI | InChI=1S/2C12H27N.C6H12FO8P/c2*1-4-7-10-13(11-8-5-2)12-9-6-3;7-3-5(10)4(9)2(1-8)14-6(3)15-16(11,12)13/h2*4-12H2,1-3H3;2-6,8-10H,1H2,(H2,11,12,13)/t;;2-,3+,4-,5-,6-/m..0/s1 |
| InChIKey | ZBRLIYAKUJKMAM-KMUSOQAKSA-N |
| Mol Weight | 632.84 g/mol |
| Molecular Formula | C30H66FN2O8P |
| Exact Mass | 632.454082 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6tUeuP8aGuL |
|---|---|
| Name | 2-DEOXY-2-FLUORO-ALPHA-D-MANNOPYRANOSYL-BIS-(TRIBUTYLAMMONIUM)-PHOSPHATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H66FN2O8P |
| InChI | InChI=1S/2C12H27N.C6H12FO8P/c2*1-4-7-10-13(11-8-5-2)12-9-6-3;7-3-5(10)4(9)2(1-8)14-6(3)15-16(11,12)13/h2*4-12H2,1-3H3;2-6,8-10H,1H2,(H2,11,12,13)/t;;2-,3+,4-,5-,6-/m..0/s1 |
| InChIKey | ZBRLIYAKUJKMAM-KMUSOQAKSA-N |
| Literature Reference Author | R.V.STICK,A.G.WATTS |
| Literature Reference Citation | MH.CHEM.,133,541(2002) |
| Literature Reference DOI | 10.1007/s007060200027 |
| Molecular Weight | 632.835 g/mol |
| Solvent | D2O |
| Source File Reference | UWKP11555 |