| SpectraBase Compound ID | ILfaGYXi2wD |
|---|---|
| InChI | InChI=1S/C7H12O4/c1-2-3-4-5(6(8)9)7(10)11/h5H,2-4H2,1H3,(H,8,9)(H,10,11) |
| InChIKey | MCRZWYDXIGCFKO-UHFFFAOYSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C7H12O4 |
| Exact Mass | 160.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 5zsYhzfV5BQ |
|---|---|
| Name | Butylmalonic acid |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 101133 |
| CAS Registry Number | 534-59-8 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O4 |
| InChI | InChI=1S/C7H12O4/c1-2-3-4-5(6(8)9)7(10)11/h5H,2-4H2,1H3,(H,8,9)(H,10,11) |
| InChIKey | MCRZWYDXIGCFKO-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 99% |
| Solvent | CDCl3 & DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_000023 |