| SpectraBase Compound ID | HQGDLbphfUF |
|---|---|
| InChI | InChI=1S/C21H28O13/c22-7-12-15(27)17(29)18(30)20(31-12)34-21(9-24)19(16(28)13(8-23)33-21)32-14(26)6-3-10-1-4-11(25)5-2-10/h1-6,12-13,15-20,22-25,27-30H,7-9H2/b6-3+/t12-,13?,15-,16?,17+,18-,19?,20-,21?/m1/s1 |
| InChIKey | FLMDUXSVNZEHLA-BALXBMRYSA-N |
| Mol Weight | 488.44 g/mol |
| Molecular Formula | C21H28O13 |
| Exact Mass | 488.152991 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B0iB5jClvqx |
|---|---|
| Name | 3-O-p-Coumaroyl-.beta.,D-fructofuranosyl .alpha.,D-glucopyranoside |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H28O13 |
| InChI | InChI=1S/C21H28O13/c22-7-12-15(27)17(29)18(30)20(31-12)34-21(9-24)19(16(28)13(8-23)33-21)32-14(26)6-3-10-1-4-11(25)5-2-10/h1-6,12-13,15-20,22-25,27-30H,7-9H2/b6-3+/t12-,13?,15-,16?,17+,18-,19?,20-,21?/m1/s1 |
| InChIKey | FLMDUXSVNZEHLA-BALXBMRYSA-N |
| Molecular Weight | 488.442 g/mol |
| SMILES | OC1C(C(O[C@@]2([C@@]([C@]([C@@]([C@](O2)(CO)[H])(O)[H])(O)[H])(O)[H])[H])(OC1CO)CO)OC(\C=C\c1ccc(cc1)O)=O |
| SPLASH | splash10-00dm-2900000000-dd927e3559ca8a6339cc |
| Source of Spectrum | E1-38-417-1 |
| Wiley ID | 1518229 |