| SpectraBase Compound ID | BjSKqoLuJnD |
|---|---|
| InChI | InChI=1S/C21H24O6/c1-10(2)12-6-15(22)13-8-18(27-21(13)24)19(11(3)4)17-9-14(20(23)25-5)16(7-12)26-17/h8-9,12,15,18-19,22H,1,3,6-7H2,2,4-5H3/t12-,15-,18?,19?/m1/s1 |
| InChIKey | MNRPADZXFBZZNX-LVSUGJLMSA-N |
| Mol Weight | 372.42 g/mol |
| Molecular Formula | C21H24O6 |
| Exact Mass | 372.157288 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9T8Pi1tAzOd |
|---|---|
| Name | Gorgiacerol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H24O6 |
| InChI | InChI=1S/C21H24O6/c1-10(2)12-6-15(22)13-8-18(27-21(13)24)19(11(3)4)17-9-14(20(23)25-5)16(7-12)26-17/h8-9,12,15,18-19,22H,1,3,6-7H2,2,4-5H3/t12-,15-,18?,19?/m1/s1 |
| InChIKey | MNRPADZXFBZZNX-LVSUGJLMSA-N |
| Molecular Weight | 372.417 g/mol |
| SMILES | O[C@@]1(C[C@](Cc2c(cc(C(C3C=C1C(O3)=O)C(=C)C)o2)C(=O)OC)(C(=C)C)[H])[H] |
| SPLASH | splash10-0006-0927000000-120f803dcb70f29aa976 |
| Source of Spectrum | G4-58-1977-2 |
| Wiley ID | 1606114 |