| SpectraBase Compound ID | 1uBaRTQ2b2S |
|---|---|
| InChI | InChI=1S/C20H33ClO3/c1-17(2)13-6-10-19(4)14(18(13,3)9-8-15(17)22)7-11-20(5,24-19)16(23)12-21/h13-14,16,23H,6-12H2,1-5H3/t13-,14+,16?,18-,19+,20-/m1/s1 |
| InChIKey | WUVFQBDFNUJWIH-HFTDLLCNSA-N |
| Mol Weight | 356.9 g/mol |
| Molecular Formula | C20H33ClO3 |
| Exact Mass | 356.211823 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6uHwaQQDZEm |
|---|---|
| Name | AGALLOCHIN-A;3-OXO-ENT-13-EPI-8(13)-EPOXY-15-CHLORO-14-HYDROXYLABDANE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H33ClO3 |
| InChI | InChI=1S/C20H33ClO3/c1-17(2)13-6-10-19(4)14(18(13,3)9-8-15(17)22)7-11-20(5,24-19)16(23)12-21/h13-14,16,23H,6-12H2,1-5H3/t13-,14+,16?,18-,19+,20-/m1/s1 |
| InChIKey | WUVFQBDFNUJWIH-HFTDLLCNSA-N |
| Literature Reference Author | A.S.R.ANJANEYULU,V.L.RAO |
| Literature Reference Citation | PHYTOCHEM.,55,891(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00251-X |
| Molecular Weight | 356.933 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU2687 |