| SpectraBase Compound ID | AeiCaBrjcSD |
|---|---|
| InChI | InChI=1S/C7H10O4/c1-5(7(9)11-3)4-6(8)10-2/h4H,1-3H3/b5-4- |
| InChIKey | WQEXBUQDXKPVHR-PLNGDYQASA-N |
| Mol Weight | 158.15 g/mol |
| Molecular Formula | C7H10O4 |
| Exact Mass | 158.057909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ELXe5gTDlFr |
|---|---|
| Name | Dimethyl citraconate |
| CAS Registry Number | 617-54-9 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H10O4 |
| InChI | InChI=1S/C7H10O4/c1-5(7(9)11-3)4-6(8)10-2/h4H,1-3H3/b5-4- |
| InChIKey | WQEXBUQDXKPVHR-PLNGDYQASA-N |
| Instrument Name | Jeol FX-100 |
| Literature Reference | T. Anthonsen, S. Hagen, Phytochem. 19, 2375 (1980). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |