| SpectraBase Compound ID | IHgvGUpadXN |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-8(7-13)10-3-5-11(6-4-10)9(2)12(14)15/h3-9H,1-2H3,(H,14,15) |
| InChIKey | HARBCTJNDTYPKJ-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 | FzwCW7KOVFx |
|---|---|
| Name | BENZENE, 1-(1-CARBOXYETHYL)-4-(1-FORMYLETHYL)- |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-8(7-13)10-3-5-11(6-4-10)9(2)12(14)15/h3-9H,1-2H3,(H,14,15) |
| InChIKey | HARBCTJNDTYPKJ-UHFFFAOYSA-N |
| Molecular Weight | 206.0939 |
| SMILES | OC(=O)C(C)c1ccc(C(C=O)C)cc1 |
| SPLASH | splash10-004i-4900000000-2182d96b4e3183906b6f |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |