| SpectraBase Compound ID | 6QfsW3O3uLE |
|---|---|
| InChI | InChI=1S/C10H10O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7H,2H2,1H3 |
| InChIKey | QKLCQKPAECHXCQ-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 | K0zI9TaUxcb |
|---|---|
| Name | BENZENEACETIC ACID, alpha-OXO-, ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H10O3 |
| InChI | InChI=1S/C10H10O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7H,2H2,1H3 |
| InChIKey | QKLCQKPAECHXCQ-UHFFFAOYSA-N |
| Molecular Weight | 178.0627 |
| SMILES | c1(C(C(OCC)=O)=O)ccccc1 |
| SPLASH | splash10-0a4i-4900000000-b082ea430f21ff6e4e35 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |