![2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-4,4a-dimethyl-6-(1-methylethenyl)-, [4R-(4.alpha.,4a.alpha.,6.beta.)]-](/api/spectrum/D1MmfcJ666k/structure.png?h=300&w=458 "2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-4,4a-dimethyl-6-(1-methylethenyl)-, [4R-(4.alpha.,4a.alpha.,6.beta.)]-")
| SpectraBase Compound ID | 4oEhFUSghD3 |
|---|---|
| InChI | InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3 |
| InChIKey | WTOYNNBCKUYIKC-UHFFFAOYSA-N |
| Mol Weight | 218.34 g/mol |
| Molecular Formula | C15H22O |
| Exact Mass | 218.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D1MmfcJ666k |
|---|---|
| Name | Nootkatone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O |
| InChI | InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3 |
| InChIKey | WTOYNNBCKUYIKC-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 218.340 g/mol |
| SMILES | CC(=C)C1CCC=2C(C1)(C)C(C)CC(C2)=O |
| SPLASH | splash10-0006-8900000000-68de9630940527abf23b |
| Source of Spectrum | SRH-2022-7136-0 |
| Wiley ID | 1828936 |