SpectraBase Spectrum ID |
9OssOC0aDN6 |
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 |
splash10-01pa-0900000000-4d8612e5ddf24a803a3d |
Sample Comments |
Mixture of isomers |
Source of Spectrum |
ARK-2005-37-23 |
Wiley ID |
1870944 |