| SpectraBase Spectrum ID |
E3Ga7om2bZD |
| Name |
4-Hexylbenzonitrile |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17N |
| InChI |
InChI=1S/C13H17N/c1-2-3-4-5-6-12-7-9-13(11-14)10-8-12/h7-10H,2-6H2,1H3 |
| InChIKey |
QLSILVVVEOHLOG-UHFFFAOYSA-N |
| Instrument Name |
HP 5995C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101571 |
| Molecular Weight |
187.286 g/mol |
| Reported Formula |
C13H17N |
| SMILES |
C(CCCCC)c1ccc(cc1)C#N |
| SPLASH |
splash10-000b-0900000000-24decc03d76afa8a856c |
| Source of Spectrum |
ACI-60-SM16-29 |
| Wiley ID |
1880338 |
