| SpectraBase Spectrum ID |
KZjTK7IB8yq |
| Name |
2-methyl-4-(2-((4-(trifluoromethyl)phenyl)ethynyl)phenyl)but-3-yn-2-yl acetate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.118064274 u |
| Formula |
C22H17F3O2 |
| InChI |
InChI=1S/C22H17F3O2/c1-16(26)27-21(2,3)15-14-19-7-5-4-6-18(19)11-8-17-9-12-20(13-10-17)22(23,24)25/h4-7,9-10,12-13H,1-3H3 |
| InChIKey |
QMEZLKPCZVVAMT-UHFFFAOYSA-N |
| Instrument Name |
JEOL JMD-700 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.201501725 |
| Molecular Weight |
370.371 g/mol |
| Quality |
25 |
| Reported Formula |
C22H17O2F3 |
| SMILES |
C1=C(C(=CC=C1)C#CC1=CC=C(C=C1)C(F)(F)F)C#CC(OC(C)=O)(C)C |
| SPLASH |
splash10-03di-0039000000-7f64fb699b4d1726f606 |
| Source of Spectrum |
QE-21-SM49-1m (DOI: 10.1002/chem.201501725) |
| Thin-Layer Chromatography |
0.58 (PE/EA, 5:1) |
| Wiley ID |
1907069 |
