| SpectraBase Compound ID | 7L4MJsZa9kf |
|---|---|
| InChI | InChI=1S/C7H12O3/c1-4-10-7(9)5(2)6(3)8/h5H,4H2,1-3H3 |
| InChIKey | FNENWZWNOPCZGK-UHFFFAOYSA-N |
| Mol Weight | 144.17 g/mol |
| Molecular Formula | C7H12O3 |
| Exact Mass | 144.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JJMZ3hhUXda |
|---|---|
| Name | BUTANOIC ACID, 2-METHYL-3-OXO-, ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O3 |
| InChI | InChI=1S/C7H12O3/c1-4-10-7(9)5(2)6(3)8/h5H,4H2,1-3H3 |
| InChIKey | FNENWZWNOPCZGK-UHFFFAOYSA-N |
| Molecular Weight | 144.0783 |
| SMILES | CC(C(C)C(OCC)=O)=O |
| SPLASH | splash10-0006-9100000000-8a07dad48e50b4067d03 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |