| SpectraBase Compound ID | z1z45mLvuA |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-6-5-7(2)11(12(14)15)8(3)10(6)9(4)13/h5H,1-4H3,(H,14,15) |
| InChIKey | BTOFJUUSHPHYSU-UHFFFAOYSA-N |
| Mol Weight | 206.24 g/mol |
| Molecular Formula | C12H14O3 |
| Exact Mass | 206.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IdR6fVsihA4 |
|---|---|
| Name | 3-Acetyl-2,4,6-trimethyl-benzoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-6-5-7(2)11(12(14)15)8(3)10(6)9(4)13/h5H,1-4H3,(H,14,15) |
| InChIKey | BTOFJUUSHPHYSU-UHFFFAOYSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | OC(c1c(c(c(cc1C)C)C(=O)C)C)=O |
| SPLASH | splash10-0006-7920000000-05c8fa78707a2b41b67a |
| Synonyms | 3-Ethanoyl-2,4,6-trimethyl-benzoic acid |
| Wiley ID | 1448973 |