| SpectraBase Spectrum ID |
FBkqXzbb38J |
| Name |
7-Phenyl-3-(trifluoromethyl)hept-4-ynenitrile |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H12F3N |
| InChI |
InChI=1S/C14H12F3N/c15-14(16,17)13(10-11-18)9-5-4-8-12-6-2-1-3-7-12/h1-3,6-7,13H,4,8,10H2 |
| InChIKey |
VUXAPWBXDJYHNQ-UHFFFAOYSA-N |
| Instrument Name |
HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.orglett.1c01988 |
| Molecular Weight |
251.252 g/mol |
| Reported Formula |
C14H12F3N |
| SMILES |
C(C#CC(C(F)(F)F)CC#N)Cc1ccccc1 |
| SPLASH |
splash10-0006-9030000000-85c04c571811307139e3 |
| Source of Spectrum |
A1-23-SM99-4s |
| Wiley ID |
1870263 |
