| SpectraBase Spectrum ID |
FcMmGZK60j1 |
| Name |
5-Phenyl-3-(trifluoromethyl)pent-4-ynenitrile |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H8F3N |
| InChI |
InChI=1S/C12H8F3N/c13-12(14,15)11(8-9-16)7-6-10-4-2-1-3-5-10/h1-5,11H,8H2 |
| InChIKey |
ITWAVOABONEBDJ-UHFFFAOYSA-N |
| Instrument Name |
HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.orglett.1c01988 |
| Molecular Weight |
223.198 g/mol |
| Reported Formula |
C12H8F3N |
| SMILES |
c1cc(C#CC(C(F)(F)F)CC#N)ccc1 |
| SPLASH |
splash10-001i-0930000000-298b7ea8edf8b3045220 |
| Source of Spectrum |
A1-23-SM81-4j |
| Wiley ID |
1870255 |
