| SpectraBase Spectrum ID |
JGK4612lOIN |
| Name |
4-(1-Benzyl-1H-pyrrol-2-yl)benzonitrile |
| Appearance |
Yellow oil |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
258.115698459 u |
| Formula |
C18H14N2 |
| InChI |
InChI=1S/C18H14N2/c19-13-15-8-10-17(11-9-15)18-7-4-12-20(18)14-16-5-2-1-3-6-16/h1-12H,14H2 |
| InChIKey |
JPLGCRVLATYKEK-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890N GC-5975 MS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201705326 |
| Molecular Weight |
258.324 g/mol |
| Quality |
77 |
| SMILES |
C1(=CC=CC=C1)CN1C(=CC=C1)C1=CC=C(C=C1)C#N |
| SPLASH |
splash10-0006-9040000000-c15f1b7637f6d00fcdbd |
| Source of Spectrum |
QE-24-SM11-11-1 (DOI: 10.1002/chem.201705326) |
| Wiley ID |
1901405 |
