For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4'-[Difluoro(3,4,5-trifluorophenoxy)methyl]-3',5'-difluoro-4-biphenol-4-n-propylcyclohexyl formate
SpectraBase Compound ID 22bRXkKPbg2
InChI InChI=1S/C29H25F7O3/c1-2-3-16-4-6-18(7-5-16)28(37)38-20-10-8-17(9-11-20)19-12-22(30)26(23(31)13-19)29(35,36)39-21-14-24(32)27(34)25(33)15-21/h8-16,18H,2-7H2,1H3
InChIKey QXQRJWNYMIHNIB-UHFFFAOYSA-N
Mol Weight 554.5 g/mol
Molecular Formula C29H25F7O3
Exact Mass 554.169192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3LC1O7DcRTV
Name 4'-[Difluoro(3,4,5-trifluorophenoxy)methyl]-3',5'-difluoro-4-biphenol-4-n-propylcyclohexyl formate
Appearance White needle crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H25F7O3
InChI InChI=1S/C29H25F7O3/c1-2-3-16-4-6-18(7-5-16)28(37)38-20-10-8-17(9-11-20)19-12-22(30)26(23(31)13-19)29(35,36)39-21-14-24(32)27(34)25(33)15-21/h8-16,18H,2-7H2,1H3
InChIKey QXQRJWNYMIHNIB-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 554.505 g/mol
SMILES c1c(F)c(c(cc1-c1ccc(cc1)OC(C1CCC(CC1)CCC)=O)F)C(Oc1cc(c(c(c1)F)F)F)(F)F
SPLASH splash10-0kdi-0930000000-f62fab135d6a5de689be
Source of Spectrum CN103242854A
Wiley ID 1847359