| SpectraBase Compound ID | 5rCeaCKdHdh |
|---|---|
| InChI | InChI=1S/C6H11N/c1-6(2)4-3-5-7/h6H,3-4H2,1-2H3 |
| InChIKey | DUJMVKJJUANUMQ-UHFFFAOYSA-N |
| Mol Weight | 97.16 g/mol |
| Molecular Formula | C6H11N |
| Exact Mass | 97.089149 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I1tUAKS7h36 |
|---|---|
| Name | Isocapronitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H11N |
| InChI | InChI=1S/C6H11N/c1-6(2)4-3-5-7/h6H,3-4H2,1-2H3 |
| InChIKey | DUJMVKJJUANUMQ-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 97.161 g/mol |
| SMILES | C(#N)CCC(C)C |
| SPLASH | splash10-0a6r-9000000000-2eb0ac7c28e222124ad7 |
| Source of Spectrum | SRH-2022-4005-0 |
| Wiley ID | 1826209 |