| SpectraBase Spectrum ID |
8oxeDuYwMjy |
| Name |
1,2-bis[2',2',2'-Trifluoro-1'-93'',4'-DIMETHOXYPHENYL0ETHYL]-4,5-dimethoxybenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
574.179007594 u |
| Formula |
C28H28F6O6 |
| InChI |
InChI=1S/C28H28F6O6/c1-35-19-9-7-15(11-21(19)37-3)25(27(29,30)31)17-13-23(39-5)24(40-6)14-18(17)26(28(32,33)34)16-8-10-20(36-2)22(12-16)38-4/h7-14,25-26H,1-6H3 |
| InChIKey |
JYNZZDVEWROPDP-UHFFFAOYSA-N |
| Molecular Weight |
574.516 g/mol |
| SMILES |
C=1(C(C(C(F)(F)F)C2=CC(=C(OC)C=C2)OC)=CC(=C(C1)OC)OC)C(C(F)(F)F)C=1C=C(C(OC)=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948223 |