| SpectraBase Spectrum ID |
rIdtLae0Qq |
| Name |
2-{[4-(trifluoromethyl)phenyl]ethynyl}benzaldehyde |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.060549398 u |
| Formula |
C16H9F3O |
| InChI |
InChI=1S/C16H9F3O/c17-16(18,19)15-9-6-12(7-10-15)5-8-13-3-1-2-4-14(13)11-20/h1-4,6-7,9-11H |
| InChIKey |
GPRDKCXNKMUPEY-UHFFFAOYSA-N |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/anie.201508461 |
| Molecular Weight |
274.242 g/mol |
| Quality |
7 |
| Reported Formula |
C16H9F3O |
| SMILES |
C1=C(C=CC(=C1)C#CC1=C(C=CC=C1)C=O)C(F)(F)F |
| SPLASH |
splash10-00di-0190000000-d04b766a5daf9ff09964 |
| Source of Spectrum |
ACI-55-SM5-1c (DOI: 10.1002/anie.201508461) |
| Thin-Layer Chromatography |
0.44 (PE/EA, 5:1) |
| Wiley ID |
1897462 |
