| SpectraBase Spectrum ID |
GdyEvoDHKKE |
| Name |
2-(But-3-ynyl)-3-(2-oxocyclohexyl)isoindolin-1-one |
| Appearance |
Yellow viscous oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
281.141578854 u |
| Formula |
C18H19NO2 |
| InChI |
InChI=1S/C18H19NO2/c1-2-3-12-19-17(15-10-6-7-11-16(15)20)13-8-4-5-9-14(13)18(19)21/h1,4-5,8-9,15,17H,3,6-7,10-12H2 |
| InChIKey |
OMDZZMKZEPSFLW-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201504772 |
| Quality |
8 |
| Reported Formula |
C18H19NO2 |
| SMILES |
C(CC#C)N1C(=O)C2=C(C=CC=C2)C1C1CCCCC1=O |
| SPLASH |
splash10-00di-0930000000-f896e3e94977cae7e13b |
| Sample Comments |
dr = 50:50 |
| Source of Spectrum |
QE-22-SM10-4fa (DOI: 10.1002/chem.201504772) |
| Thin-Layer Chromatography |
0.18 (cyclohexane/EtOAc, 80:20) |
| Wiley ID |
1903115 |
