| SpectraBase Compound ID | 2FOCieF59fK |
|---|---|
| InChI | InChI=1S/C9H16O3/c1-5-7(10)9(3,4)8(11)12-6-2/h5-6H2,1-4H3 |
| InChIKey | WIOMWIBESRUZSR-UHFFFAOYSA-N |
| Mol Weight | 172.22 g/mol |
| Molecular Formula | C9H16O3 |
| Exact Mass | 172.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IqO9pPh6Ml8 |
|---|---|
| Name | 2,2-DIMETHYL-3-OXOPENTANOIC ACID, ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16O3 |
| InChI | InChI=1S/C9H16O3/c1-5-7(10)9(3,4)8(11)12-6-2/h5-6H2,1-4H3 |
| InChIKey | WIOMWIBESRUZSR-UHFFFAOYSA-N |
| Molecular Weight | 172.1095 |
| SMILES | CCC(C(C(OCC)=O)(C)C)=O |
| SPLASH | splash10-056r-9000000000-11f2763ff00a098054e0 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |