| SpectraBase Compound ID | JxVczqsA2OW |
|---|---|
| InChI | InChI=1S/C12H20O3/c1-2-15-12(14)9-5-7-10-6-3-4-8-11(10)13/h10H,2-9H2,1H3 |
| InChIKey | DONLABSITAABEZ-UHFFFAOYSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | H2XJfrdXqBL |
|---|---|
| Name | 4-(2-OXOCYCLOHEXYL)BUTYRIC ACID, ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H20O3 |
| InChI | InChI=1S/C12H20O3/c1-2-15-12(14)9-5-7-10-6-3-4-8-11(10)13/h10H,2-9H2,1H3 |
| InChIKey | DONLABSITAABEZ-UHFFFAOYSA-N |
| Molecular Weight | 212.1407 |
| SMILES | C1(=O)CCCCC1CCCC(OCC)=O |
| SPLASH | splash10-059w-9300000000-f6938ff4689109522b58 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |