| SpectraBase Compound ID | KiBYQ4bZs2h |
|---|---|
| InChI | InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4+ |
| InChIKey | WSWCOQWTEOXDQX-MQQKCMAXSA-N |
| Mol Weight | 112.13 g/mol |
| Molecular Formula | C6H8O2 |
| Exact Mass | 112.052429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | QfaW6n5HVg |
|---|---|
| Name | (E,E)-2,4-HEXADIENOIC-ACID;SORBIC-ACID |
| Compound Number | 220 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H8O2 |
| InChI | InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4+ |
| InChIKey | WSWCOQWTEOXDQX-MQQKCMAXSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 112.128 g/mol |
| Sample ID | 3540 |
| Solvent | DMSO-D6 |