| SpectraBase Spectrum ID |
2N62Bj21Vlf |
| Name |
5-Oxo-3,3,6-trimethylbicyclo[4.2.0]octane-7-(exo)-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H17NO |
| InChI |
InChI=1S/C12H17NO/c1-11(2)5-8-4-9(7-13)12(8,3)10(14)6-11/h8-9H,4-6H2,1-3H3 |
| InChIKey |
XPAKYIMCQUIKHG-UHFFFAOYSA-N |
| Molecular Weight |
191.274 g/mol |
| SMILES |
C12(C(CC(CC2CC1C#N)(C)C)=O)C |
| SPLASH |
splash10-0006-9000000000-33bb743e3e25ba505129 |
| Source of Spectrum |
I-81-420-6 |
| Synonyms |
3,3,6-trimethyl-5-oxobicyclo[4.2.0]octane-7-carbonitrile |
| Wiley ID |
1517395 |
![5-Oxo-3,3,6-trimethylbicyclo[4.2.0]octane-7-(exo)-carbonitrile](/api/spectrum/2N62Bj21Vlf/structure.png?h=300&w=458 "5-Oxo-3,3,6-trimethylbicyclo[4.2.0]octane-7-(exo)-carbonitrile")
