| SpectraBase Compound ID | wPK4rPERNV |
|---|---|
| InChI | InChI=1S/C12H12N2/c1-2-3-12(9-14)11-6-4-10(8-13)5-7-11/h4-7,12H,2-3H2,1H3 |
| InChIKey | RDPVSZZOSGRARC-UHFFFAOYSA-N |
| Mol Weight | 184.24 g/mol |
| Molecular Formula | C12H12N2 |
| Exact Mass | 184.100048 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Bo0GuBTHMHJ |
|---|---|
| Name | 4-(1-Cyanobutyl)benzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12N2 |
| InChI | InChI=1S/C12H12N2/c1-2-3-12(9-14)11-6-4-10(8-13)5-7-11/h4-7,12H,2-3H2,1H3 |
| InChIKey | RDPVSZZOSGRARC-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/ol200194y |
| Molecular Weight | 184.242 g/mol |
| SMILES | c1c(ccc(C(CCC)C#N)c1)C#N |
| SPLASH | splash10-0006-1900000000-2c3a5e13c68e3c59713a |
| Source of Spectrum | A1-13-1690/SMS13-4h |
| Wiley ID | 1752935 |