| SpectraBase Compound ID | 22lNBVvbp5D |
|---|---|
| InChI | InChI=1S/C21H28O/c1-4-15-5-6-18-17-8-12-21(11-7-16(22)13-14(21)2)19(17)9-10-20(15,18)3/h4,7,11,13,15,17-19H,1,5-6,8-10,12H2,2-3H3/t15-,17-,18-,19-,20+,21-/m0/s1 |
| InChIKey | WBURTZSEYTVSRX-IHLDHJRKSA-N |
| Mol Weight | 296.45 g/mol |
| Molecular Formula | C21H28O |
| Exact Mass | 296.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IjAEF5oQspo |
|---|---|
| Name | CARIJODIENONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O |
| InChI | InChI=1S/C21H28O/c1-4-15-5-6-18-17-8-12-21(11-7-16(22)13-14(21)2)19(17)9-10-20(15,18)3/h4,7,11,13,15,17-19H,1,5-6,8-10,12H2,2-3H3/t15-,17-,18-,19-,20+,21-/m0/s1 |
| InChIKey | WBURTZSEYTVSRX-IHLDHJRKSA-N |
| Literature Reference Author | A.R.DIAZ-MARRERO,G.PORRAS,Z.ARAGON,J.M.DELAROSA,E.DORTA,M.CU ETO,L.DCROZ,J.MATE,J |
| Literature Reference Citation | J.NAT.PROD.,74,292(2011) |
| Literature Reference DOI | 10.1021/np1007608 |
| Molecular Weight | 296.453 g/mol |
| Sample ID | 37567 |
| Solvent | C6D6 |