| SpectraBase Compound ID | LSPjggbKSNi |
|---|---|
| InChI | InChI=1S/C34H38O17/c1-18(35)47-29-26(51-34(50-21(4)38)31(49-20(3)37)30(29)48-19(2)36)17-46-33-23(24(15-28(40)43-5)25(16-45-33)32(41)42)13-14-44-27(39)12-11-22-9-7-6-8-10-22/h6-13,16,24,26,29-31,33-34H,14-15,17H2,1-5H3,(H,41,42)/b12-11-,23-13+/t24-,26+,29+,30-,31+,33-,34+/m0/s1 |
| InChIKey | GGBORJLZZWPEIO-LCRAXXFQSA-N |
| Mol Weight | 718.7 g/mol |
| Molecular Formula | C34H38O17 |
| Exact Mass | 718.2109 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7raoPo34gvT |
|---|---|
| Name | Isojasminside tetraacetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H38O17 |
| InChI | InChI=1S/C34H38O17/c1-18(35)47-29-26(51-34(50-21(4)38)31(49-20(3)37)30(29)48-19(2)36)17-46-33-23(24(15-28(40)43-5)25(16-45-33)32(41)42)13-14-44-27(39)12-11-22-9-7-6-8-10-22/h6-13,16,24,26,29-31,33-34H,14-15,17H2,1-5H3,(H,41,42)/b12-11-,23-13+/t24-,26+,29+,30-,31+,33-,34+/m0/s1 |
| InChIKey | GGBORJLZZWPEIO-LCRAXXFQSA-N |
| Molecular Weight | 718.661 g/mol |
| SMILES | OC(C=1[C@](\C(=C/COC(\C=C/c2ccccc2)=O)[C@@](OC1)(OC[C@@]1([C@]([C@](OC(=O)C)([C@]([C@@](O1)(OC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H])[H])(CC(=O)OC)[H])=O |
| SPLASH | splash10-00l6-5900000000-a2fb34fefdf24cd1bc8d |
| Source of Spectrum | QA-46-199-5 |
| Wiley ID | 863169 |