| SpectraBase Compound ID | Jcmm9DsCsJs |
|---|---|
| InChI | InChI=1S/C41H58O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-22,24-32H,14,23,33H2,1-11H3/b13-12+,24-15+,25-16+,29-17+,30-18+,32-19+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+ |
| InChIKey | OCDSWQXGIQUZCF-AGVJHCIFSA-N |
| Mol Weight | 566.9 g/mol |
| Molecular Formula | C41H58O |
| Exact Mass | 566.448766 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DxVG2QaP4Vt |
|---|---|
| Name | ANHYDRORHODOVIBRIN;1-METHOXY-3,4-DIDEHYDRO-1,2-DIHYDRO-PSI,PSI-CAROTENE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H58O |
| InChI | InChI=1S/C41H58O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-22,24-32H,14,23,33H2,1-11H3/b13-12+,24-15+,25-16+,29-17+,30-18+,32-19+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+ |
| InChIKey | OCDSWQXGIQUZCF-AGVJHCIFSA-N |
| Literature Reference Author | B.F.LUTNAES,J.KRANE,S.LIAAEN-JENSEN |
| Literature Reference Citation | MAGN.RES.CHEM.,40,797(2002) |
| Literature Reference DOI | 10.1002/mrc.1102 |
| Molecular Weight | 566.911 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP6454 |