| SpectraBase Compound ID | LStlYdIW6Bl |
|---|---|
| InChI | InChI=1S/C17H24O5/c1-9-6-14-12(10(2)16(20)22-14)7-17(8-21-11(3)18)13(9)4-5-15(17)19/h9,12-15,19H,2,4-8H2,1,3H3/t9-,12+,13-,14+,15-,17+/m0/s1 |
| InChIKey | YPJDNPTZPPPTEV-AZQFOKQKSA-N |
| Mol Weight | 308.37 g/mol |
| Molecular Formula | C17H24O5 |
| Exact Mass | 308.162374 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | pLWrc8RAe |
|---|---|
| Name | [(3aR,5S,5aS,8S,8aS,9aR)-5-methyl-1-methylidene-8-oxidanyl-2-oxidanylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-8a-yl]methyl ethanoate |
| CAS Registry Number | 76467-17-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H24O5 |
| InChI | InChI=1S/C17H24O5/c1-9-6-14-12(10(2)16(20)22-14)7-17(8-21-11(3)18)13(9)4-5-15(17)19/h9,12-15,19H,2,4-8H2,1,3H3/t9-,12+,13-,14+,15-,17+/m0/s1 |
| InChIKey | YPJDNPTZPPPTEV-AZQFOKQKSA-N |
| Molecular Weight | 308.374 g/mol |
| SMILES | O[C@@]1([C@@]2([C@]([C@](C[C@]3(OC(C([C@]3(C2)[H])=C)=O)[H])(C)[H])(CC1)[H])COC(=O)C)[H] |
| SPLASH | splash10-0f79-0940000000-2231fd339d851bb88ca3 |
| Source of Spectrum | J-46-1360-0 |
| Synonyms | [(3aR,5S,5aS,8S,8aS,9aR)-8-hydroxy-5-methyl-1-methylene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-8a-yl]methyl acetate [(3aR,5S,5aS,8S,8aS,9aR)-8-hydroxy-5-methyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-8a-yl]methyl acetate Acetic acid [(3aR,5S,5aS,8S,8aS,9aR)-8-hydroxy-5-methyl-1-methylene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-8a-yl]methyl ester |
| Wiley ID | 1309784 |