| SpectraBase Spectrum ID |
HeTycfcofey |
| Name |
1,1'-(4,6-bis(Heptafluorobutyryl)oxy-1,3-phenylene)bisethanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
586.009732254 u |
| Formula |
C18H8F14O6 |
| InChI |
InChI=1S/C18H8F14O6/c1-5(33)7-3-8(6(2)34)10(38-12(36)14(21,22)16(25,26)18(30,31)32)4-9(7)37-11(35)13(19,20)15(23,24)17(27,28)29/h3-4H,1-2H3 |
| InChIKey |
OPCKPPHIAOAZAI-UHFFFAOYSA-N |
| Molecular Weight |
586.234 g/mol |
| SMILES |
C1(=CC(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)=C(C=C1C(C)=O)C(=O)C)OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977335 |
