| SpectraBase Compound ID | 3FCuPLGCcc3 |
|---|---|
| InChI | InChI=1S/C19H24O8/c1-7-4-10(20)27-14(7)17(3)5-9-18-6-25-19(24,16(17)18)13(22)8(2)11(18)12(21)15(23)26-9/h4,8-9,11-14,16,21-22,24H,5-6H2,1-3H3/t8-,9-,11-,12-,13-,14-,16-,17-,18+,19+/m1/s1 |
| InChIKey | IRGXOUHTTCDCTK-BVPSEFMXSA-N |
| Mol Weight | 380.39 g/mol |
| Molecular Formula | C19H24O8 |
| Exact Mass | 380.147118 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A1PmYB4pvqt |
|---|---|
| Name | Cedronolactone C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H24O8 |
| InChI | InChI=1S/C19H24O8/c1-7-4-10(20)27-14(7)17(3)5-9-18-6-25-19(24,16(17)18)13(22)8(2)11(18)12(21)15(23)26-9/h4,8-9,11-14,16,21-22,24H,5-6H2,1-3H3/t8-,9-,11-,12-,13-,14-,16-,17-,18+,19+/m1/s1 |
| InChIKey | IRGXOUHTTCDCTK-BVPSEFMXSA-N |
| Molecular Weight | 380.393 g/mol |
| SMILES | O[C@]12[C@]3([C@@]4([C@@]([C@](C(O[C@@]4(C[C@@]3([C@]3(C(=CC(O3)=O)C)[H])C)[H])=O)(O)[H])([C@]([C@]2(O)[H])(C)[H])[H])CO1)[H] |
| SPLASH | splash10-000b-8934000000-1f376b858e6620a8a23b |
| Source of Spectrum | G4-61-779-3 |
| Wiley ID | 1607312 |