| SpectraBase Compound ID | 9vLa35P3wmq |
|---|---|
| InChI | InChI=1S/C20H32O/c1-15(11-14-21)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h11,14,17-18H,2,6-10,12-13H2,1,3-5H3/b15-11+/t17-,18-,20+/m0/s1 |
| InChIKey | QZIWEZUJYZIRFB-ATPOGHATSA-N |
| Mol Weight | 288.5 g/mol |
| Molecular Formula | C20H32O |
| Exact Mass | 288.245316 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L1a6paK8p6h |
|---|---|
| Name | Labda-8(17)-13(E)-dien-15-al |
| Classification | Diterpenoids |
| Copyright | Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass | 288.245315649 u |
| Formula | C20H32O |
| InChI | InChI=1S/C20H32O/c1-15(11-14-21)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h11,14,17-18H,2,6-10,12-13H2,1,3-5H3/b15-11+/t17-,18-,20+/m0/s1 |
| InChIKey | QZIWEZUJYZIRFB-ATPOGHATSA-N |
| Molecular Weight | 288.475 g/mol |
| Number of Peaks | 17 |
| SMILES | CC1([C@@]2(CCC(=C)[C@@]([C@]2(CCC1)C)(CC\C(=C\C=O)C)[H])[H])C |
| SPLASH | splash10-0006-9100000000-65d2e23c7a94c5698f89 |
| Source of Spectrum | FF-23-123-60 (DOI: 10.1002/ffj.1865) |
| Synonyms | (E)-3-methyl-5-((1S,4aS,8aS)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl)pent-2-enal (E)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-2-pentenal (E)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enal (E)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-pent-2-enal |
| Wiley ID | 1775501 |