| SpectraBase Spectrum ID |
LmJfilTN8yj |
| Name |
Gallacetophenone-4'-methylether, bis(heptafluorobutyrate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
574.009732254 u |
| Formula |
C17H8F14O6 |
| InChI |
InChI=1S/C17H8F14O6/c1-5(32)6-3-4-7(35-2)9(37-11(34)13(20,21)15(24,25)17(29,30)31)8(6)36-10(33)12(18,19)14(22,23)16(26,27)28/h3-4H,1-2H3 |
| InChIKey |
KUQMMVYSQNULJN-UHFFFAOYSA-N |
| Molecular Weight |
574.223 g/mol |
| SMILES |
C(C)(=O)C1=C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)=C(C=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90666 |
