SpectraBase Spectrum ID |
7CEhx6bGHZM |
Name |
2-[4-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluoro-phenyl]phenyl]ethylcycloheptane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H25F7O |
InChI |
InChI=1S/C28H25F7O/c29-22-13-20(19-11-9-18(10-12-19)8-7-17-5-3-1-2-4-6-17)14-23(30)26(22)28(34,35)36-21-15-24(31)27(33)25(32)16-21/h9-17H,1-8H2 |
InChIKey |
JZHAAVRTSMZDSL-UHFFFAOYSA-N |
Instrument Name |
Agilent-MS5975C |
Ionization Type |
EI |
Molecular Weight |
510.496 g/mol |
SMILES |
c1cc(ccc1CCC1CCCCCC1)-c1cc(c(c(c1)F)C(Oc1cc(c(c(c1)F)F)F)(F)F)F |
SPLASH |
splash10-0udi-0090000000-fb547b6dd480463f87ed |
Source of Spectrum |
CN103467253A |
Wiley ID |
1847598 |