| SpectraBase Compound ID | FYZW3jKCs99 |
|---|---|
| InChI | InChI=1S/C22H26O8/c1-5-12(2)21(26)30-20-18-13(3)22(27)29-17(18)9-15(10-23)7-6-8-16(11-24)19(20)28-14(4)25/h5,8-9,11,17-20,23H,3,6-7,10H2,1-2,4H3/b12-5+,15-9-,16-8-/t17-,18+,19-,20+/m1/s1 |
| InChIKey | VOLLLWYRXDPFJB-PECJHDHWSA-N |
| Mol Weight | 418.44 g/mol |
| Molecular Formula | C22H26O8 |
| Exact Mass | 418.162768 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J1zVoJDaWX0 |
|---|---|
| Name | LECOCARPINOLIDE_B |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H26O8 |
| InChI | InChI=1S/C22H26O8/c1-5-12(2)21(26)30-20-18-13(3)22(27)29-17(18)9-15(10-23)7-6-8-16(11-24)19(20)28-14(4)25/h5,8-9,11,17-20,23H,3,6-7,10H2,1-2,4H3/b12-5+,15-9-,16-8-/t17-,18+,19-,20+/m1/s1 |
| InChIKey | VOLLLWYRXDPFJB-PECJHDHWSA-N |
| Literature Reference Author | F.A.MACIAS,N.H.FISCHER |
| Literature Reference Citation | PHYTOCHEM.,31,2747(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83624-8 |
| Molecular Weight | 418.444 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ23161 |