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Tris{3-(4-trifluoromethylphenyl)-2-methoxyphenyl}methane
SpectraBase Compound ID 1Ao0At9jZMK
InChI InChI=1S/C43H31F9O3/c1-53-38-31(25-13-19-28(20-14-25)41(44,45)46)7-4-10-34(38)37(35-11-5-8-32(39(35)54-2)26-15-21-29(22-16-26)42(47,48)49)36-12-6-9-33(40(36)55-3)27-17-23-30(24-18-27)43(50,51)52/h4-24,37H,1-3H3
InChIKey DANZTXMURIWSAN-UHFFFAOYSA-N
Mol Weight 766.7 g/mol
Molecular Formula C43H31F9O3
Exact Mass 766.212948 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID cZ7Tt2zGi
Name Tris{3-(4-trifluoromethylphenyl)-2-methoxyphenyl}methane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C43H31F9O3
InChI InChI=1S/C43H31F9O3/c1-53-38-31(25-13-19-28(20-14-25)41(44,45)46)7-4-10-34(38)37(35-11-5-8-32(39(35)54-2)26-15-21-29(22-16-26)42(47,48)49)36-12-6-9-33(40(36)55-3)27-17-23-30(24-18-27)43(50,51)52/h4-24,37H,1-3H3
InChIKey DANZTXMURIWSAN-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1002/chem.202003594
Molecular Weight 766.704 g/mol
Reported Formula C43H31F9O3
SMILES c1c(c(c(cc1)C(c1cccc(c1OC)-c1ccc(cc1)C(F)(F)F)c1cccc(c1OC)-c1ccc(cc1)C(F)(F)F)OC)-c1ccc(cc1)C(F)(F)F
SPLASH splash10-014i-0070000900-0a1cfed8c78fcea107b6
Source of Spectrum QE-26-SM15-10g
Wiley ID 1841127