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1-[4-ANISYL-[4-(TRIFLUOROMETHYL)-PHENYL]-PHENYLMETHYL]-4-[4-ANISYL-[4-(TRIFLUOROMETHYL)-PHENYL]-METHYL]-BENZENE
SpectraBase Compound ID 9FK4Vay3SUt
InChI InChI=1S/C42H32F6O2/c1-49-37-24-12-30(13-25-37)39(29-10-16-35(17-11-29)41(43,44)45)28-8-14-32(15-9-28)40(31-6-4-3-5-7-31,34-22-26-38(50-2)27-23-34)33-18-20-36(21-19-33)42(46,47)48/h3-27,39H,1-2H3
InChIKey YHCDMHIXWSPQQU-UHFFFAOYSA-N
Mol Weight 682.7 g/mol
Molecular Formula C42H32F6O2
Exact Mass 682.230649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3FcawDyWsT
Name Benzene, 1-[(4-methoxyphenyl)phenyl[4-(trifluoromethyl)phenyl]methyl]-4-[(4-methoxyphenyl)[4-(trifluoromethyl)phenyl]methyl]-
CAS Registry Number 121443-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H32F6O2
InChI InChI=1S/C42H32F6O2/c1-49-37-24-12-30(13-25-37)39(29-10-16-35(17-11-29)41(43,44)45)28-8-14-32(15-9-28)40(31-6-4-3-5-7-31,34-22-26-38(50-2)27-23-34)33-18-20-36(21-19-33)42(46,47)48/h3-27,39H,1-2H3
InChIKey YHCDMHIXWSPQQU-UHFFFAOYSA-N
Molecular Weight 682.706 g/mol
SMILES C(c1ccc(C(c2ccc(C(c3ccc(C(F)(F)F)cc3)(c3ccc(cc3)OC)c3ccccc3)cc2)c2ccc(cc2)OC)cc1)(F)(F)F
SPLASH splash10-0543-0002039000-aa3aec3e0a4ba1c9f0f7
Source of Spectrum C-111-5850-6
Synonyms 1-[(4-methoxyphenyl)(4-{(4-methoxyphenyl)[4-(trifluoromethyl)phenyl]methyl}phenyl)phenylmethyl]-4-(trifluoromethyl)benzene 1-[4-anisyl[4-(trifluoromethyl)phenyl]phenylmethyl]-4-[4-anisyl[4-(trifluoromethyl)phenyl]methyl]benzene
Wiley ID 1414415