| SpectraBase Compound ID | 9DU3hpwd7Hw |
|---|---|
| InChI | InChI=1S/C21H30O3/c1-14-6-5-7-18-20(14,3)12-17-15(2)21(18,19(22-4)24-17)10-8-16-9-11-23-13-16/h6,9,11,13,15,17-19H,5,7-8,10,12H2,1-4H3/t15-,17-,18+,19+,20+,21-/m1/s1 |
| InChIKey | MJUKJRODFNJMPC-PTDVTHDLSA-N |
| Mol Weight | 330.47 g/mol |
| Molecular Formula | C21H30O3 |
| Exact Mass | 330.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | t3y5gYn9GM |
|---|---|
| Name | 20-O-METHYLPTYCHONAL_ACETAL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O3 |
| InChI | InChI=1S/C21H30O3/c1-14-6-5-7-18-20(14,3)12-17-15(2)21(18,19(22-4)24-17)10-8-16-9-11-23-13-16/h6,9,11,13,15,17-19H,5,7-8,10,12H2,1-4H3/t15-,17-,18+,19+,20+,21-/m1/s1 |
| InChIKey | MJUKJRODFNJMPC-PTDVTHDLSA-N |
| Literature Reference Author | W.TANG,H.HIOKI,K.HARADA,M.KUBO,Y.FUKUYAMA |
| Literature Reference Citation | J.NAT.PROD.,71,1760(2008) |
| Literature Reference DOI | 10.1021/np8004002 |
| Molecular Weight | 330.467 g/mol |
| Sample ID | 29192 |
| Solvent | CDCl3 |