| SpectraBase Compound ID | 7gxKcQcTy1q |
|---|---|
| InChI | InChI=1S/C7H12O3/c1-5(2)10-7(9)4-6(3)8/h5H,4H2,1-3H3 |
| InChIKey | GVIIRWAJDFKJMJ-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 | FTH5u4OySFT |
|---|---|
| Name | 3-OXOBUTYRIC ACID, ISOPROPYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O3 |
| InChI | InChI=1S/C7H12O3/c1-5(2)10-7(9)4-6(3)8/h5H,4H2,1-3H3 |
| InChIKey | GVIIRWAJDFKJMJ-UHFFFAOYSA-N |
| Molecular Weight | 144.0783 |
| SMILES | CC(CC(OC(C)C)=O)=O |
| SPLASH | splash10-0006-9000000000-4c5bacf70838bf563b1e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |