| SpectraBase Compound ID | 3AiLJMVG3wd |
|---|---|
| InChI | InChI=1S/C10H14O4/c1-10(6-9(13)14-2)7(11)4-3-5-8(10)12/h3-6H2,1-2H3 |
| InChIKey | FIMBJHGEULZSHJ-UHFFFAOYSA-N |
| Mol Weight | 198.22 g/mol |
| Molecular Formula | C10H14O4 |
| Exact Mass | 198.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BTkWujwmMwp |
|---|---|
| Name | (1-METHYL-2,6-DIOXO-CYCLOHEXYL)ACETIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H14O4 |
| InChI | InChI=1S/C10H14O4/c1-10(6-9(13)14-2)7(11)4-3-5-8(10)12/h3-6H2,1-2H3 |
| InChIKey | FIMBJHGEULZSHJ-UHFFFAOYSA-N |
| Molecular Weight | 198.0888 |
| SMILES | C1(CC(OC)=O)(C)C(=O)CCCC1=O |
| SPLASH | splash10-07bu-8900000000-423bc908396bcfdb4f5c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |