| SpectraBase Compound ID | 4ZNa5eqnyRI |
|---|---|
| InChI | InChI=1S/C8H11N/c1-4-5-8(2,3)6-7-9/h1H,5-6H2,2-3H3 |
| InChIKey | QOTCBZMWSRSKPA-UHFFFAOYSA-N |
| Mol Weight | 121.18 g/mol |
| Molecular Formula | C8H11N |
| Exact Mass | 121.089149 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JGFgLypM6DH |
|---|---|
| Name | 3,3-Dimethyl-5-hexynenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H11N |
| InChI | InChI=1S/C8H11N/c1-4-5-8(2,3)6-7-9/h1H,5-6H2,2-3H3 |
| InChIKey | QOTCBZMWSRSKPA-UHFFFAOYSA-N |
| Molecular Weight | 121.183 g/mol |
| SMILES | C(#N)CC(CC#C)(C)C |
| SPLASH | splash10-001i-9000000000-32956164ecfbc189b47c |
| Source of Spectrum | J-58-1906-25 |
| Synonyms | 3,3-Dimethylhex-5-ynenitrile |
| Wiley ID | 1127628 |