| SpectraBase Compound ID | LIbXQ1bDvSu |
|---|---|
| InChI | InChI=1S/C15H20O2/c1-9-5-4-6-11-7-13-12(8-15(9,11)3)10(2)14(16)17-13/h7,9,13H,4-6,8H2,1-3H3/t9-,13-,15+/m0/s1 |
| InChIKey | IEECLYVVZNWCCX-DYQSUWPFSA-N |
| Mol Weight | 232.32 g/mol |
| Molecular Formula | C15H20O2 |
| Exact Mass | 232.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J75OVbqexYa |
|---|---|
| Name | Eremophila-7(11),9-dien-8,12-olide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.146329882 u |
| Formula | C15H20O2 |
| InChI | InChI=1S/C15H20O2/c1-9-5-4-6-11-7-13-12(8-15(9,11)3)10(2)14(16)17-13/h7,9,13H,4-6,8H2,1-3H3/t9-,13-,15+/m0/s1 |
| InChIKey | IEECLYVVZNWCCX-DYQSUWPFSA-N |
| Molecular Weight | 232.323 g/mol |
| SMILES | C1=2[C@@](OC(C2C)=O)(C=C2[C@](C1)([C@](CCC2)(C)[H])C)[H] |