| SpectraBase Compound ID | Eez8ogXeVd2 |
|---|---|
| InChI | InChI=1S/C7H12O5/c1-4(6(9)11-2)5(8)7(10)12-3/h4-5,8H,1-3H3 |
| InChIKey | RUUHUDXJDHEPBZ-UHFFFAOYSA-N |
| Mol Weight | 176.17 g/mol |
| Molecular Formula | C7H12O5 |
| Exact Mass | 176.068473 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FTJ8CBBsGLY |
|---|---|
| Name | BUTANEDIOIC ACID, 2-HYDROXY-3-METHYL-, DIMETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O5 |
| InChI | InChI=1S/C7H12O5/c1-4(6(9)11-2)5(8)7(10)12-3/h4-5,8H,1-3H3 |
| InChIKey | RUUHUDXJDHEPBZ-UHFFFAOYSA-N |
| Molecular Weight | 176.0681 |
| SMILES | OC(C(C(OC)=O)C)C(=O)OC |
| SPLASH | splash10-0a4r-9100000000-019c5a3bfaa8ee12ea03 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |