| SpectraBase Compound ID | KLA5gqXa6d7 |
|---|---|
| InChI | InChI=1S/C41H60O/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/h12-13,15-16,18-22,24-28,30-32H,14,17,23,29,33H2,1-11H3/b13-12+,24-15+,25-16+,30-18+,32-19+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+ |
| InChIKey | FJOCMTHZSURUFA-AXYGSFPTSA-N |
| Mol Weight | 568.9 g/mol |
| Molecular Formula | C41H60O |
| Exact Mass | 568.464417 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AY5Qt43gUKE |
|---|---|
| Name | 1-METHOXY-3,4-DIDEHYDRO-1,2,7',8'-TETRAHYDRO-XI,XI-CAROTENE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H60O |
| InChI | InChI=1S/C41H60O/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/h12-13,15-16,18-22,24-28,30-32H,14,17,23,29,33H2,1-11H3/b13-12+,24-15+,25-16+,30-18+,32-19+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+ |
| InChIKey | FJOCMTHZSURUFA-AXYGSFPTSA-N |
| Literature Reference Author | R.GEBHARD,K.VANDERHOEF,A.W.M.LEFEBER,C.ERKELENS,J.LUGTENBURG |
| Literature Reference Citation | REC.TR.CH.P.-B.,109,378(1990) |
| Literature Reference DOI | 10.1002/recl.19901090604 |
| Molecular Weight | 568.927 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRK556 |