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1-[bis(p-Methoxyphenyl)aminophenyl]-2-{[p'-(bis<pentachlorophenyl)methyl]-tetrachlorophenyl}-acetylene
SpectraBase Compound ID 47JX0tnkknJ
InChI InChI=1S/C41H19Cl14NO2/c1-57-21-12-8-19(9-13-21)56(20-10-14-22(58-2)15-11-20)18-6-3-17(4-7-18)5-16-23-28(42)30(44)25(31(45)29(23)43)24(26-32(46)36(50)40(54)37(51)33(26)47)27-34(48)38(52)41(55)39(53)35(27)49/h3-4,6-15,24H,1-2H3
InChIKey ZKPVJKHTBKDULO-UHFFFAOYSA-N
Mol Weight 1053.9 g/mol
Molecular Formula C41H19Cl14NO2
Exact Mass 1046.705517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 133YCazUqSP
Name 1-[bis(p-Methoxyphenyl)aminophenyl]-2-{[p'-(bis
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H19Cl14NO2
InChI InChI=1S/C41H19Cl14NO2/c1-57-21-12-8-19(9-13-21)56(20-10-14-22(58-2)15-11-20)18-6-3-17(4-7-18)5-16-23-28(42)30(44)25(31(45)29(23)43)24(26-32(46)36(50)40(54)37(51)33(26)47)27-34(48)38(52)41(55)39(53)35(27)49/h3-4,6-15,24H,1-2H3
InChIKey ZKPVJKHTBKDULO-UHFFFAOYSA-N
Molecular Weight 1053.950 g/mol
SMILES c1(C(c2c(c(c(Cl)c(c2Cl)Cl)Cl)Cl)c2c(c(Cl)c(c(c2Cl)Cl)C#Cc2ccc(N(c3ccc(OC)cc3)c3ccc(cc3)OC)cc2)Cl)c(c(c(Cl)c(c1Cl)Cl)Cl)Cl
SPLASH splash10-0f6y-9000000000-ab947abb3cc0d6ce609f
Source of Spectrum C-129-5526-11
Wiley ID 1701903