| SpectraBase Spectrum ID |
3d3qkmNvSvB |
| Name |
Flustramine L |
| Appearance |
Oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29BrN2O |
| InChI |
InChI=1S/C21H29BrN2O/c1-13(2)6-7-15-12-16(22)18-17(19(15)25)21(9-8-14(3)4)10-11-24(5)20(21)23-18/h6,8,12,20,23,25H,7,9-11H2,1-5H3/t20-,21-/m0/s1 |
| InChIKey |
HFPWSDSFBVKNTG-SFTDATJTSA-N |
| Instrument Name |
Dupont model 21-110B double-focusing |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900282j |
| Molecular Weight |
405.380 g/mol |
| Optical Rotation |
[a]D = -53 (c = 0.30, CHCl3) |
| Reported Formula |
C21H29(79)BrN2O |
| SMILES |
N1[C@@]2([C@](c3c1c(cc(c3O)CC=C(C)C)Br)(CCN2C)CC=C(C)C)[H] |
| SPLASH |
splash10-052s-1049500000-5e3942d50178f66484a0 |
| Source of Spectrum |
G4-72-1780-9 |
| Thin-Layer Chromatography |
Rf = 0.22 |
| Wiley ID |
1872074 |
