| SpectraBase Compound ID | HXXjiGZYTDY |
|---|---|
| InChI | InChI=1S/C11H11N/c1-9-5-3-4-6-11(9)10(2)7-8-12/h3-7H,1-2H3/b10-7+ |
| InChIKey | BNKVXBPBWMBCJT-JXMROGBWSA-N |
| Mol Weight | 157.22 g/mol |
| Molecular Formula | C11H11N |
| Exact Mass | 157.089149 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 49Ye6ds4MLu |
|---|---|
| Name | (E)-3-(o-Tolyl)but-2-enenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H11N |
| InChI | InChI=1S/C11H11N/c1-9-5-3-4-6-11(9)10(2)7-8-12/h3-7H,1-2H3/b10-7+ |
| InChIKey | BNKVXBPBWMBCJT-JXMROGBWSA-N |
| Literature Reference DOI | 10.1002/anie.201402053 |
| Molecular Weight | 157.216 g/mol |
| SMILES | c1c(c(\C(=C\C#N)C)ccc1)C |
| SPLASH | splash10-0arr-0900000000-e59475d9388c5f1468dc |
| Source of Spectrum | ACI-53-SM13-3c |
| Wiley ID | 1782460 |