| SpectraBase Spectrum ID |
H4TKY3jWf7B |
| Name |
5-Oxo-3,3-dimethylbicyclo[4.2.0]octane-7-(exo)-carbonitrile |
| Alternate Name(s) |
3,3-dimethyl-5-oxobicyclo[4.2.0]octane-7-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H15NO |
| InChI |
InChI=1S/C11H15NO/c1-11(2)4-7-3-8(6-12)10(7)9(13)5-11/h7-8,10H,3-5H2,1-2H3 |
| InChIKey |
VWIHUSIJCXYROF-UHFFFAOYSA-N |
| Molecular Weight |
177.247 g/mol |
| SMILES |
C1(C2C(C#N)CC2CC(C1)(C)C)=O |
| SPLASH |
splash10-001i-9100000000-1342c7fc39ddb4847b85 |
| Source of Spectrum |
I-81-420-3 |
| Wiley ID |
1517397 |
![5-Oxo-3,3-dimethylbicyclo[4.2.0]octane-7-(exo)-carbonitrile](/api/spectrum/H4TKY3jWf7B/structure.png?h=300&w=458 "5-Oxo-3,3-dimethylbicyclo[4.2.0]octane-7-(exo)-carbonitrile")
