| SpectraBase Compound ID | J7bycQm2NsM |
|---|---|
| InChI | InChI=1S/C10H13NO/c1-7-8(6-11)10(2,3)5-4-9(7)12/h4-5H2,1-3H3 |
| InChIKey | INYFORYUOHLNGE-UHFFFAOYSA-N |
| Mol Weight | 163.22 g/mol |
| Molecular Formula | C10H13NO |
| Exact Mass | 163.099714 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DRCXBFoVz39 |
|---|---|
| Name | 3-Cyano-2,4,4-trimethyl-2-cyclohexenone |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H13NO |
| InChI | InChI=1S/C10H13NO/c1-7-8(6-11)10(2,3)5-4-9(7)12/h4-5H2,1-3H3 |
| InChIKey | INYFORYUOHLNGE-UHFFFAOYSA-N |
| Molecular Weight | 163.0994 |
| SMILES | C1C(=O)C(C)=C(C#N)C(C)(C)C1 |
| SPLASH | splash10-0100-9500000000-947237bc70f114683324 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |