| SpectraBase Compound ID | IwBahzgHT5p |
|---|---|
| InChI | InChI=1S/C7H11NO/c1-7(2)6-9-5-3-4-8/h1,3,5-6H2,2H3 |
| InChIKey | QADWFIJAPKGJRO-UHFFFAOYSA-N |
| Mol Weight | 125.17 g/mol |
| Molecular Formula | C7H11NO |
| Exact Mass | 125.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CbLcU6dBAFs |
|---|---|
| Name | 3-(2-Methylallyloxy)propanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 125.084063977 u |
| Formula | C7H11NO |
| InChI | InChI=1S/C7H11NO/c1-7(2)6-9-5-3-4-8/h1,3,5-6H2,2H3 |
| InChIKey | QADWFIJAPKGJRO-UHFFFAOYSA-N |
| Molecular Weight | 125.171 g/mol |
| SMILES | C(#N)CCOCC(=C)C |