| SpectraBase Spectrum ID |
CnKhUmC8Qu9 |
| Name |
3-(10-Bromodecyl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H27BrO4 |
| InChI |
InChI=1S/C22H27BrO4/c1-16(24)27-22-19(14-8-6-4-2-3-5-7-11-15-23)20(25)17-12-9-10-13-18(17)21(22)26/h9-10,12-13H,2-8,11,14-15H2,1H3 |
| InChIKey |
ANQDGGFLIIOAAT-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/ml300242v |
| Molecular Weight |
435.358 g/mol |
| SMILES |
C(Br)CCCCCCCCCC1=C(C(c2c(C1=O)cccc2)=O)OC(C)=O |
| SPLASH |
splash10-000i-0914000000-1e23e8581f733f6ef0f7 |
| Source of Spectrum |
MCS-3-SM2-7b |
| Thin-Layer Chromatography |
Rf = 0.48 (hexanes/EtOAc, 7:1) |
| Wiley ID |
1864079 |
