| SpectraBase Compound ID | CoMJSn3S5NI |
|---|---|
| InChI | InChI=1S/C13H24O/c1-5-6-7-13(4)9-11(14)8-12(2,3)10-13/h5-10H2,1-4H3 |
| InChIKey | OQYPINSIPBBGJS-UHFFFAOYSA-N |
| Mol Weight | 196.33 g/mol |
| Molecular Formula | C13H24O |
| Exact Mass | 196.182715 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FbLKhyAvQu8 |
|---|---|
| Name | CYCLOHEXANONE, 5-BUTYL-3,3,5-TRIMETHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H24O |
| InChI | InChI=1S/C13H24O/c1-5-6-7-13(4)9-11(14)8-12(2,3)10-13/h5-10H2,1-4H3 |
| InChIKey | OQYPINSIPBBGJS-UHFFFAOYSA-N |
| Molecular Weight | 196.1821 |
| SMILES | C1C(=O)CC(C)(CCCC)CC1(C)C |
| SPLASH | splash10-053i-9500000000-ae89e76843c15ff8a04a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |