| SpectraBase Compound ID | yvUaMSEa2n |
|---|---|
| InChI | InChI=1S/C6H9NO5/c1-2-12-6(9)3-5(8)4-7(10)11/h2-4H2,1H3 |
| InChIKey | HKELPIVELKXPPH-UHFFFAOYSA-N |
| Mol Weight | 175.14 g/mol |
| Molecular Formula | C6H9NO5 |
| Exact Mass | 175.048072 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7SI1MEM5nzN |
|---|---|
| Name | 4-NITRO-3-OXOBUTYRIC ACID, ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H9NO5 |
| InChI | InChI=1S/C6H9NO5/c1-2-12-6(9)3-5(8)4-7(10)11/h2-4H2,1H3 |
| InChIKey | HKELPIVELKXPPH-UHFFFAOYSA-N |
| Molecular Weight | 175.0478 |
| SMILES | C(N(=O)=O)C(CC(=O)OCC)=O |
| SPLASH | splash10-0006-9100000000-658a2af561102074e126 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |