| SpectraBase Compound ID | 57F2QZP1bgX |
|---|---|
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3 |
| InChIKey | JHJCHCSUEGPIGE-UHFFFAOYSA-N |
| Mol Weight | 194.32 g/mol |
| Molecular Formula | C13H22O |
| Exact Mass | 194.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Big0Bki0844 |
|---|---|
| Name | 2-BUTANONE, 4-(2,6,6-TRIMETHYL-2-CYCLOHEXEN-1-YL)- |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C13H22O |
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3 |
| InChIKey | JHJCHCSUEGPIGE-UHFFFAOYSA-N |
| Molecular Weight | 194.1665 |
| SMILES | C1(C)(C)C(CCC(C)=O)C(C)=CCC1 |
| SPLASH | splash10-0077-9700000000-11926d4d89eeaff18a99 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |