SpectraBase Spectrum ID |
GpoN6OcNEfq |
Name |
1,1,1,5,5,6,7,7,7-Nonafluoroheptane-2,4-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.998932802 u |
Formula |
C7H3F9O2 |
InChI |
InChI=1S/C7H3F9O2/c8-4(7(14,15)16)5(9,10)2(17)1-3(18)6(11,12)13/h4H,1H2 |
InChIKey |
OCQSZEZZZKYJSC-UHFFFAOYSA-N |
Molecular Weight |
290.085 g/mol |
SMILES |
C(CC(C(F)(F)F)=O)(C(F)(F)C(C(F)(F)F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96919 |