| SpectraBase Compound ID | IVWiKDjml1U |
|---|---|
| InChI | InChI=1S/2C22H36O5/c2*1-14(26-16(3)24)8-9-17-21(6)11-7-10-20(4,5)18(21)12-19-22(17,27-19)13-25-15(2)23/h2*14,17-19H,7-13H2,1-6H3/t14?,17-,18+,19+,21-,22-;14?,17-,18+,19-,21-,22+/m11/s1 |
| InChIKey | XCQHTYFUWGRWKM-CMLLWVIUSA-N |
| Mol Weight | 761.1 g/mol |
| Molecular Formula | C44H72O10 |
| Exact Mass | 760.512549 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Io44ELaiqDU |
|---|---|
| Name | 13,17-DIACETOXY-7,8-EPOXY-14,15-DINOR-LABDANE |
| Compound Number | 24 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H72O10 |
| InChI | InChI=1S/2C22H36O5/c2*1-14(26-16(3)24)8-9-17-21(6)11-7-10-20(4,5)18(21)12-19-22(17,27-19)13-25-15(2)23/h2*14,17-19H,7-13H2,1-6H3/t14?,17-,18+,19+,21-,22-;14?,17-,18+,19-,21-,22+/m11/s1 |
| InChIKey | XCQHTYFUWGRWKM-CMLLWVIUSA-N |
| Literature Reference Author | J.M.L.RODILLA,D.DIEZ,J.G.URONES,P.M.ROCHA |
| Literature Reference Citation | MOLECULES,9,300(2004) |
| Literature Reference DOI | 10.3390/90500300 |
| Molecular Weight | 761.050 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5945 |