![3-[(1E)-buta-1,3-dienyl]-2,4,4-trimethylcyclohex-2-en-1-one](/api/spectrum/2vAYKBlO06l/structure.png?h=300&w=458 "3-[(1E)-buta-1,3-dienyl]-2,4,4-trimethylcyclohex-2-en-1-one")
| SpectraBase Compound ID | 81BfKtDlvvY |
|---|---|
| InChI | InChI=1S/C13H18O/c1-5-6-7-11-10(2)12(14)8-9-13(11,3)4/h5-7H,1,8-9H2,2-4H3/b7-6+ |
| InChIKey | NSFWSHKUSWODJO-VOTSOKGWSA-N |
| Mol Weight | 190.29 g/mol |
| Molecular Formula | C13H18O |
| Exact Mass | 190.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2vAYKBlO06l |
|---|---|
| Name | 3-(Butadienyl-1)-2,4,4-trimethyl-2-cyclohexenone |
| CAS Registry Number | 84696-84-4 |
| Comments | WHE-7814-29 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H18O |
| InChI | InChI=1S/C13H18O/c1-5-6-7-11-10(2)12(14)8-9-13(11,3)4/h5-7H,1,8-9H2,2-4H3/b7-6+ |
| InChIKey | NSFWSHKUSWODJO-VOTSOKGWSA-N |
| Instrument Name | Bruker WM-360 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |