| SpectraBase Compound ID | BmbQw8aYyZZ |
|---|---|
| InChI | InChI=1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13) |
| InChIKey | KMQLIDDEQAJAGJ-UHFFFAOYSA-N |
| Mol Weight | 178.19 g/mol |
| Molecular Formula | C10H10O3 |
| Exact Mass | 178.062994 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HsjFiGbss3n |
|---|---|
| Name | 4-OXO-4-PHENYLBUTYRIC ACID |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H10O3 |
| InChI | InChI=1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13) |
| InChIKey | KMQLIDDEQAJAGJ-UHFFFAOYSA-N |
| Molecular Weight | 178.0627 |
| SMILES | OC(CCC(c1ccccc1)=O)=O |
| SPLASH | splash10-0a4i-7900000000-0e07868f6b3efb28564f |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |