| SpectraBase Spectrum ID |
1rk6gFtgav2 |
| Name |
2-[(2'E,6'E,10'E)-5'-Oxo-13'-hydroxy-3',7',11',15'-tetramethylhexadeca-2',6',10',14'-tetraenyl]-6-methylhydroquinone |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H38O4 |
| InChI |
InChI=1S/C27H38O4/c1-18(2)12-24(28)13-19(3)8-7-9-20(4)14-25(29)15-21(5)10-11-23-17-26(30)16-22(6)27(23)31/h8,10,12,14,16-17,24,28,30-31H,7,9,11,13,15H2,1-6H3/b19-8+,20-14+,21-10+ |
| InChIKey |
OZNBGGKJHMIWEF-WJNRHBMWSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030082f |
| Molecular Weight |
426.597 g/mol |
| Optical Rotation |
[a]D28 = +4.6 (c = 0.1, EtOH) |
| Reported Formula |
C27H36O3 |
| SMILES |
Oc1cc(c(c(C\C=C\(CC(\C=C\(CC\C=C\(CC(C=C(C)C)O)C)C)=O)C)c1)O)C |
| SPLASH |
splash10-0570-1910200000-2a580b66318ef3964786 |
| Source of Spectrum |
G4-66-973-3 |
| Wiley ID |
1881459 |
![2-[(2'E,6'E,10'E)-5'-Oxo-13'-hydroxy-3',7',11',15'-tetramethylhexadeca-2',6',10',14'-tetraenyl]-6-methylhydroquinone](/api/spectrum/1rk6gFtgav2/structure.png?h=300&w=458 "2-[(2'E,6'E,10'E)-5'-Oxo-13'-hydroxy-3',7',11',15'-tetramethylhexadeca-2',6',10',14'-tetraenyl]-6-methylhydroquinone")
