| SpectraBase Compound ID | 7ymUXuc5VDU |
|---|---|
| InChI | InChI=1S/C13H24O4/c1-5-7-9-16-11(14)13(3,4)12(15)17-10-8-6-2/h5-10H2,1-4H3 |
| InChIKey | WHUUQIWGJLPUBN-UHFFFAOYSA-N |
| Mol Weight | 244.33 g/mol |
| Molecular Formula | C13H24O4 |
| Exact Mass | 244.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GOE8NFCHHUe |
|---|---|
| Name | Propanedioic acid, dimethyl-, dibutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.167459249 u |
| Formula | C13H24O4 |
| InChI | InChI=1S/C13H24O4/c1-5-7-9-16-11(14)13(3,4)12(15)17-10-8-6-2/h5-10H2,1-4H3 |
| InChIKey | WHUUQIWGJLPUBN-UHFFFAOYSA-N |
| Molecular Weight | 244.331 g/mol |
| SMILES | C(C(C(OCCCC)=O)(C)C)(OCCCC)=O |