| SpectraBase Spectrum ID |
39SBQY7LX4Q |
| Name |
Ethyl-2-cyano-3-methyl-5-(2,6,6-trimethylcyclohex-1-en-1-yl)pent-2-enoate |
| Appearance |
Pale yellow oil |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H27NO2 |
| GC Oven Program |
Oven temp 325 oC, Split injector |
| InChI |
InChI=1S/C18H27NO2/c1-6-21-17(20)15(12-19)13(2)9-10-16-14(3)8-7-11-18(16,4)5/h6-11H2,1-5H3 |
| InChIKey |
HKSBKJUAZYMDNH-UHFFFAOYSA-N |
| Instrument Name |
Optima 5 Accent 815 |
| Ionization Type |
EI |
| Molecular Weight |
289.419 g/mol |
| SMILES |
C(OC(=O)C(C#N)=C(C)CCC=1C(C)(C)CCCC1C)C |
| SPLASH |
splash10-000j-9600000000-6569a21f85e0ccac7d60 |
| Source of Spectrum |
EP3853203A1 |
| Thin-Layer Chromatography |
Rf = 0.48 (10% EtOAc in hexane +1% Et3N) |
| Wiley ID |
1879909 |
