| SpectraBase Spectrum ID |
LNbNgG16kXN |
| Name |
3-Butylbenzonitrile |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H13N |
| InChI |
InChI=1S/C11H13N/c1-2-3-5-10-6-4-7-11(8-10)9-12/h4,6-8H,2-3,5H2,1H3 |
| InChIKey |
KHTOSIUCQBUWHE-UHFFFAOYSA-N |
| Instrument Name |
HP 5995C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101571 |
| Molecular Weight |
159.232 g/mol |
| Reported Formula |
C11H13N |
| SMILES |
c1(cccc(c1)CCCC)C#N |
| SPLASH |
splash10-014i-2900000000-231e5231f178e9402fdc |
| Source of Spectrum |
ACI-60-SM12-12 |
| Wiley ID |
1880321 |
