| SpectraBase Compound ID | CsIUJP7I9n7 |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-12-7-5-9-13(2)17(21)11-16-15(4)20(23)24-19(16)18(22)14(3)10-6-8-12/h7,14,16-19,21-22H,2,4-6,8-11H2,1,3H3/b12-7+/t14-,16-,17+,18+,19+/m0/s1 |
| InChIKey | SQZQILNEYFKUMI-YSIFGUBHSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AajUluDkEEV |
|---|---|
| Name | 3(R),13-Dihydroxycembra-4(18),7,15(17)-trien-16,14-olide |
| Alternate Name(s) | (3aS,5R,9E,14S,15R,15aR)-5,15-dihydroxy-10,14-dimethyl-3,6-dimethylidene-4,5,7,8,11,12,13,14,15,15a-decahydro-3aH-cyclotetradeca[b]furan-2-one (3aS,5R,9E,14S,15R,15aR)-10,14-dimethyl-3,6-dimethylidene-5,15-bis(oxidanyl)-4,5,7,8,11,12,13,14,15,15a-decahydro-3aH-cyclotetradeca[b]furan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O4 |
| InChI | InChI=1S/C20H30O4/c1-12-7-5-9-13(2)17(21)11-16-15(4)20(23)24-19(16)18(22)14(3)10-6-8-12/h7,14,16-19,21-22H,2,4-6,8-11H2,1,3H3/b12-7+/t14-,16-,17+,18+,19+/m0/s1 |
| InChIKey | SQZQILNEYFKUMI-YSIFGUBHSA-N |
| Molecular Weight | 334.456 g/mol |
| SMILES | O[C@]1([C@]2([C@@](C[C@](C(CC\C=C\(CCC[C@@]1(C)[H])C)=C)(O)[H])(C(C(O2)=O)=C)[H])[H])[H] |
| SPLASH | splash10-0a5c-9300000000-3f86faa1b9ecda41ca0a |
| Source of Spectrum | F-57-107-33 |
| Wiley ID | 1549055 |