| SpectraBase Compound ID | dIBtGKuCbK |
|---|---|
| InChI | InChI=1S/C6H10O4/c1-2-3-4(5(7)8)6(9)10/h4H,2-3H2,1H3,(H,7,8)(H,9,10) |
| InChIKey | VQDJODAWOFNASI-UHFFFAOYSA-N |
| Mol Weight | 146.14 g/mol |
| Molecular Formula | C6H10O4 |
| Exact Mass | 146.057909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9pGk1ge7Sr6 |
|---|---|
| Name | Propanedioic acid, propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.057908798 u |
| Formula | C6H10O4 |
| InChI | InChI=1S/C6H10O4/c1-2-3-4(5(7)8)6(9)10/h4H,2-3H2,1H3,(H,7,8)(H,9,10) |
| InChIKey | VQDJODAWOFNASI-UHFFFAOYSA-N |
| SMILES | C(=O)(O)C(C(=O)O)CCC |