| SpectraBase Compound ID | GM9xjACKLQi |
|---|---|
| InChI | InChI=1S/C9H8O3/c1-6-2-4-7(5-3-6)8(10)9(11)12/h2-5H,1H3,(H,11,12) |
| InChIKey | UIIIPQVTXBPHTI-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 | Kwh295wQMOR |
|---|---|
| Name | BENZENEACETIC ACID, 4-METHYL-alpha-OXO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H8O3 |
| InChI | InChI=1S/C9H8O3/c1-6-2-4-7(5-3-6)8(10)9(11)12/h2-5H,1H3,(H,11,12) |
| InChIKey | UIIIPQVTXBPHTI-UHFFFAOYSA-N |
| Instrument Name | 311A |
| Molecular Weight | 164.0471 |
| SMILES | OC(=O)C(=O)c1ccc(C)cc1 |
| SPLASH | splash10-014l-9400000000-7c91081d969e5b64e4d4 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |