| SpectraBase Compound ID | 71u1Dbdeo0V |
|---|---|
| InChI | InChI=1S/C9H16N2O/c1-9(2,3)5-7-11-8(12)4-6-10/h4-5,7H2,1-3H3,(H,11,12) |
| InChIKey | PUQIFSVBFVRZDA-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C9H16N2O |
| Exact Mass | 168.126263 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G32x8zlqDXQ |
|---|---|
| Name | 2-Cyano-N-(3,3-dimethylbutyl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.126263142 u |
| Formula | C9H16N2O |
| InChI | InChI=1S/C9H16N2O/c1-9(2,3)5-7-11-8(12)4-6-10/h4-5,7H2,1-3H3,(H,11,12) |
| InChIKey | PUQIFSVBFVRZDA-UHFFFAOYSA-N |
| Molecular Weight | 168.240 g/mol |
| SMILES | C(#N)CC(=O)NCCC(C)(C)C |