| SpectraBase Compound ID | 5HMzQUFU3bd |
|---|---|
| InChI | InChI=1S/C10H15NO4/c1-14-9(12)7-8(10(13)15-2)5-3-4-6-11/h8H,3-5,7H2,1-2H3 |
| InChIKey | GCUNBZUNTCPBBE-UHFFFAOYSA-N |
| Mol Weight | 213.23 g/mol |
| Molecular Formula | C10H15NO4 |
| Exact Mass | 213.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9775zTswaSq |
|---|---|
| Name | Dimethyl 2-(3-cyanopropyl)succinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.100107963 u |
| Formula | C10H15NO4 |
| InChI | InChI=1S/C10H15NO4/c1-14-9(12)7-8(10(13)15-2)5-3-4-6-11/h8H,3-5,7H2,1-2H3 |
| InChIKey | GCUNBZUNTCPBBE-UHFFFAOYSA-N |
| Molecular Weight | 213.233 g/mol |
| SMILES | C(CC#N)CC(CC(OC)=O)C(=O)OC |