| SpectraBase Compound ID | CX73V8RQt94 |
|---|---|
| InChI | InChI=1S/C9H14O3/c1-12-9(11)6-7-3-2-4-8(10)5-7/h7H,2-6H2,1H3 |
| InChIKey | XLWYQNLUACCYOT-UHFFFAOYSA-N |
| Mol Weight | 170.21 g/mol |
| Molecular Formula | C9H14O3 |
| Exact Mass | 170.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IQJja7ZedaO |
|---|---|
| Name | CYCLOHEXANEACETIC ACID, 3-OXO-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H14O3 |
| InChI | InChI=1S/C9H14O3/c1-12-9(11)6-7-3-2-4-8(10)5-7/h7H,2-6H2,1H3 |
| InChIKey | XLWYQNLUACCYOT-UHFFFAOYSA-N |
| Molecular Weight | 170.0939 |
| SMILES | C1(=O)CC(CC(OC)=O)CCC1 |
| SPLASH | splash10-0002-9200000000-8df8a5680908aa86a7c0 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |