| SpectraBase Spectrum ID |
KiLD7mKsPou |
| Name |
4-O-[(2E)-3,7-Dimethyl-2,7-octadien-5-ol]sinapyl alcohol |
| Alternate Name(s) |
Nelumol B |
| Appearance |
gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O5 |
| InChI |
InChI=1S/C21H30O5/c1-15(2)11-18(23)12-16(3)8-10-26-21-19(24-4)13-17(7-6-9-22)14-20(21)25-5/h6-8,13-14,18,22-23H,1,9-12H2,2-5H3/b7-6?,16-8+ |
| InChIKey |
PIRMSMJKOZAZOF-IMFZVERCSA-N |
| Instrument Name |
VG Auto Spec-3000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0200257 |
| Molecular Weight |
362.466 g/mol |
| SMILES |
OCC=Cc1cc(c(OC\C=C\(CC(CC(=C)C)O)C)c(c1)OC)OC |
| SPLASH |
splash10-03di-0492000000-1568b6198e831e3e970d |
| Source of Spectrum |
G4-65-904-1 |
| Thin-Layer Chromatography |
Rf = 0.46 (CHCl3/Me2CO, 3:1) |
| Wiley ID |
1883724 |
![4-O-[(2E)-3,7-Dimethyl-2,7-octadien-5-ol]sinapyl alcohol](/api/spectrum/KiLD7mKsPou/structure.png?h=300&w=458 "4-O-[(2E)-3,7-Dimethyl-2,7-octadien-5-ol]sinapyl alcohol")
