| SpectraBase Compound ID | 9TNbYFHytWR |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-7-10(4,11-7)6-5-8-9(2,3)12-8/h5-8H,1-4H3 |
| InChIKey | AJXYQJKBNYBUFD-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1uVulDbSCrw |
|---|---|
| Name | aod Alloocimene diepoxide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-7-10(4,11-7)6-5-8-9(2,3)12-8/h5-8H,1-4H3 |
| InChIKey | AJXYQJKBNYBUFD-UHFFFAOYSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | CC1C(C=CC2C(C)(C)O2)(C)O1 |