| SpectraBase Spectrum ID |
3aIGd4DdpwZ |
| Name |
2-(3,3-Dimethyl-5-oxocyclohexyl)succinonitrile |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.126263142 u |
| Formula |
C12H16N2O |
| InChI |
InChI=1S/C12H16N2O/c1-12(2)6-10(5-11(15)7-12)9(8-14)3-4-13/h9-10H,3,5-7H2,1-2H3 |
| InChIKey |
RJYXDVNIJUDEMF-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201701865 |
| Molecular Weight |
204.273 g/mol |
| Quality |
231 |
| Reported Formula |
C12H16N2O |
| SMILES |
CC1(CC(CC(C1)=O)C(C#N)CC#N)C |
| SPLASH |
splash10-001i-9100000000-f0e7681e5d3d9c94dafa |
| Sample Comments |
dr = 1.2:1 |
| Source of Spectrum |
QE-23-SM15-3j (DOI: 10.1002/chem.201701865) |
| Wiley ID |
1905572 |
