| SpectraBase Compound ID | DKoOal1zHhj |
|---|---|
| InChI | InChI=1S/C14H22O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h6,8-9,11,13H,7H2,1-5H3/b9-8+ |
| InChIKey | JZQOJFLIJNRDHK-CMDGGOBGSA-N |
| Mol Weight | 206.33 g/mol |
| Molecular Formula | C14H22O |
| Exact Mass | 206.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4E1hJOozxe7 |
|---|---|
| Name | .alpha.-Irone |
| CAS Registry Number | 79-69-6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C14H22O |
| InChI | InChI=1S/C14H22O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h6,8-9,11,13H,7H2,1-5H3/b9-8+ |
| InChIKey | JZQOJFLIJNRDHK-CMDGGOBGSA-N |
| Instrument Name | SF = 080 MHz |
| Literature Reference | J. Org. Chem. 47, 2531 (1982). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |