| SpectraBase Compound ID | LP4ZKAr33SQ |
|---|---|
| InChI | InChI=1S/C40H52/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-30-40-38(9)29-28-37(8)39(40)10/h11-12,14-19,21-30H,13,20H2,1-10H3/b12-11+,21-14+,22-16+,25-15+,30-27+,32-18+,33-19+,34-23+,35-24+,36-26+ |
| InChIKey | VJASLAGEYVTOGS-IQAIWTHGSA-N |
| Mol Weight | 532.9 g/mol |
| Molecular Formula | C40H52 |
| Exact Mass | 532.406902 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ywobEuefNr |
|---|---|
| Name | CHLOROBACTENE;PHI,PSI-CAROTENE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H52 |
| InChI | InChI=1S/C40H52/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-30-40-38(9)29-28-37(8)39(40)10/h11-12,14-19,21-30H,13,20H2,1-10H3/b12-11+,21-14+,22-16+,25-15+,30-27+,32-18+,33-19+,34-23+,35-24+,36-26+ |
| InChIKey | VJASLAGEYVTOGS-IQAIWTHGSA-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 | 532.853 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP6455 |