| SpectraBase Compound ID | B3wdF0LJn5I |
|---|---|
| InChI | InChI=1S/C21H30O5/c1-12-7-6-8-15-20(12,3)10-9-13(2)21(15,4)11-14(22)16-17(23)19(25-5)26-18(16)24/h13,15,19,23H,1,6-11H2,2-5H3 |
| InChIKey | LTLBDIPYZNUXAV-UHFFFAOYSA-N |
| Mol Weight | 362.47 g/mol |
| Molecular Formula | C21H30O5 |
| Exact Mass | 362.209324 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Grg2M5UveKp |
|---|---|
| Name | Dactyltronic Acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O5 |
| InChI | InChI=1S/C21H30O5/c1-12-7-6-8-15-20(12,3)10-9-13(2)21(15,4)11-14(22)16-17(23)19(25-5)26-18(16)24/h13,15,19,23H,1,6-11H2,2-5H3 |
| InChIKey | LTLBDIPYZNUXAV-UHFFFAOYSA-N |
| Molecular Weight | 362.466 g/mol |
| SMILES | OC1=C(C(OC1OC)=O)C(CC1(C2C(C(=C)CCC2)(C)CCC1C)C)=O |
| SPLASH | splash10-00kg-8900000000-9816951cd3f4aeb21a61 |
| Source of Spectrum | X2-57-995-1 |
| Wiley ID | 1605568 |