| SpectraBase Compound ID | 5ulgC0B7Jmc |
|---|---|
| InChI | InChI=1S/C9H8O3/c1-5-3-8(11)6(2)7(4-10)9(5)12/h3-4H,1-2H3 |
| InChIKey | BSMFUYACSXVSBD-UHFFFAOYSA-N |
| Mol Weight | 164.16 g/mol |
| Molecular Formula | C9H8O3 |
| Exact Mass | 164.047344 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LTt3cy8aqok |
|---|---|
| Name | 2-Formyl-3,6-dimethyl-1,4-benzoquinone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8O3 |
| InChI | InChI=1S/C9H8O3/c1-5-3-8(11)6(2)7(4-10)9(5)12/h3-4H,1-2H3 |
| InChIKey | BSMFUYACSXVSBD-UHFFFAOYSA-N |
| Molecular Weight | 164.160 g/mol |
| SMILES | C1(=C(C(=O)C=C(C1=O)C)C)C=O |
| SPLASH | splash10-022i-1900000000-02687df37808f138565b |
| Source of Spectrum | C3-33-1036-D |
| Wiley ID | 1696342 |