| SpectraBase Spectrum ID |
HJHa29lCJSe |
| Name |
2-Chloro-5,5,5-trifluoro-1-(trifluoromethyl)pent-1-en-3-yn-1-yl methyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
251.977661394 u |
| Formula |
C7H3ClF6O |
| InChI |
InChI=1S/C7H3ClF6O/c1-15-5(7(12,13)14)4(8)2-3-6(9,10)11/h1H3/b5-4+ |
| InChIKey |
QCQDZBMNNWWGOO-SNAWJCMRSA-N |
| Molecular Weight |
252.543 g/mol |
| SMILES |
C(\C(=C\(C(F)(F)F)OC)Cl)#CC(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954816 |
