| SpectraBase Compound ID | AOjWdvcSiML |
|---|---|
| InChI | InChI=1S/C12H14O4/c1-15-11(13)8-5-9-3-6-10(7-4-9)12(14)16-2/h3-4,6-7H,5,8H2,1-2H3 |
| InChIKey | MLKXCCLYRPKSBM-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HXHCgRmJJnN |
|---|---|
| Name | 4-(2-METHOXYCARBONYLETHYL)BENZOIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H14O4 |
| InChI | InChI=1S/C12H14O4/c1-15-11(13)8-5-9-3-6-10(7-4-9)12(14)16-2/h3-4,6-7H,5,8H2,1-2H3 |
| InChIKey | MLKXCCLYRPKSBM-UHFFFAOYSA-N |
| Molecular Weight | 222.0888 |
| SMILES | c1(C(OC)=O)ccc(CCC(OC)=O)cc1 |
| SPLASH | splash10-03k9-2910000000-b56d1f398d45f9cc5378 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |