| SpectraBase Compound ID | GODcChX9erW |
|---|---|
| InChI | InChI=1S/C12H13N/c1-3-9-12(2,10-13)11-7-5-4-6-8-11/h3-8H,1,9H2,2H3 |
| InChIKey | IWIWGVIGABEPHB-UHFFFAOYSA-N |
| Mol Weight | 171.24 g/mol |
| Molecular Formula | C12H13N |
| Exact Mass | 171.104799 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D0NZf66mOwl |
|---|---|
| Name | 2-Methyl-2-phenyl-4-pentenenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13N |
| InChI | InChI=1S/C12H13N/c1-3-9-12(2,10-13)11-7-5-4-6-8-11/h3-8H,1,9H2,2H3 |
| InChIKey | IWIWGVIGABEPHB-UHFFFAOYSA-N |
| Molecular Weight | 171.243 g/mol |
| SMILES | C(#N)C(c1ccccc1)(CC=C)C |
| SPLASH | splash10-001i-0900000000-cb6221704ce692f91291 |
| Source of Spectrum | J-61-61-4 |
| Synonyms | 2-Methyl-2-phenyl-pent-4-enenitrile |
| Wiley ID | 1168137 |