| SpectraBase Spectrum ID |
LnER4acQCrV |
| Name |
4,7a-Dimethyl-5-oxo-2,3,5,6,7,7a-hexahydro-1H-indene-1-carbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15NO |
| InChI |
InChI=1S/C12H15NO/c1-8-10-4-3-9(7-13)12(10,2)6-5-11(8)14/h9H,3-6H2,1-2H3 |
| InChIKey |
CZGPAYGJPXMISF-UHFFFAOYSA-N |
| Instrument Name |
Finnigan Mat 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0006.e04 |
| Molecular Weight |
189.258 g/mol |
| Reported Formula |
C12H15NO |
| SMILES |
C1CC2(C(=C(C1=O)C)CCC2C#N)C |
| SPLASH |
splash10-01p2-0900000000-32091389f98eec31324a |
| Sample Comments |
Mixture of isomers |
| Source of Spectrum |
ARK-2005-37-23 |
| Wiley ID |
1870945 |
