| SpectraBase Compound ID | pFtRxTE3ky |
|---|---|
| InChI | InChI=1S/C13H16O3/c1-3-16-13(15)9-8-12(14)11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3 |
| InChIKey | LFHSFGIXTQENJM-UHFFFAOYSA-N |
| Mol Weight | 220.27 g/mol |
| Molecular Formula | C13H16O3 |
| Exact Mass | 220.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FAJjQj2vL42 |
|---|---|
| Name | 4-OXO-4-p-TOLYLBUTYRIC ACID, ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H16O3 |
| InChI | InChI=1S/C13H16O3/c1-3-16-13(15)9-8-12(14)11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3 |
| InChIKey | LFHSFGIXTQENJM-UHFFFAOYSA-N |
| Molecular Weight | 220.1095 |
| SMILES | C(=O)(CCC(=O)c1ccc(C)cc1)OCC |
| SPLASH | splash10-014i-5900000000-2532776cd47a89d0755c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |