| SpectraBase Compound ID | 1aUu0O9HI3x |
|---|---|
| InChI | InChI=1S/C10H14O4/c1-7(9(11)13-3)5-6-8(2)10(12)14-4/h5-6H,1-4H3/b7-5+,8-6+ |
| InChIKey | DZQYXTIAUQLOHM-KQQUZDAGSA-N |
| Mol Weight | 198.22 g/mol |
| Molecular Formula | C10H14O4 |
| Exact Mass | 198.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GHuKFWGf9G2 |
|---|---|
| Name | Dimethyl-trans,trans-.alpha.,.alpha.-dimethylmuconate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.089208927 u |
| Formula | C10H14O4 |
| InChI | InChI=1S/C10H14O4/c1-7(9(11)13-3)5-6-8(2)10(12)14-4/h5-6H,1-4H3/b7-5+,8-6+ |
| InChIKey | DZQYXTIAUQLOHM-KQQUZDAGSA-N |
| Molecular Weight | 198.218 g/mol |
| SMILES | COC(\C(=C\C=C\(C(OC)=O)C)C)=O |