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5-(p'-Chlorophenyl)-5-phenyl-4-(di<p'-tolyl>acyl)-2-[bis(p-tolyl]-methyl-1,3,4-oxadiazoline
SpectraBase Compound ID AOzObt10c6v
InChI InChI=1S/C45H39ClN2O2/c1-30-10-18-34(19-11-30)41(35-20-12-31(2)13-21-35)43-47-48(45(50-43,38-8-6-5-7-9-38)39-26-28-40(46)29-27-39)44(49)42(36-22-14-32(3)15-23-36)37-24-16-33(4)17-25-37/h5-29,41-42H,1-4H3
InChIKey LGFKERBTLJQPQQ-UHFFFAOYSA-N
Mol Weight 675.3 g/mol
Molecular Formula C45H39ClN2O2
Exact Mass 674.270006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BkB0PAoCUHa
Name 5-(p'-Chlorophenyl)-5-phenyl-4-(diacyl)-2-[bis(p-tolyl]-methyl-1,3,4-oxadiazoline
Alternate Name(s) 1-[5-[bis(4-methylphenyl)methyl]-2-(4-chlorophenyl)-2-phenyl-1,3,4-oxadiazol-3-yl]-2,2-bis(4-methylphenyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H39ClN2O2
InChI InChI=1S/C45H39ClN2O2/c1-30-10-18-34(19-11-30)41(35-20-12-31(2)13-21-35)43-47-48(45(50-43,38-8-6-5-7-9-38)39-26-28-40(46)29-27-39)44(49)42(36-22-14-32(3)15-23-36)37-24-16-33(4)17-25-37/h5-29,41-42H,1-4H3
InChIKey LGFKERBTLJQPQQ-UHFFFAOYSA-N
Molecular Weight 675.272 g/mol
SMILES C1(N(N=C(O1)C(c1ccc(cc1)C)c1ccc(cc1)C)C(C(c1ccc(cc1)C)c1ccc(cc1)C)=O)(c1ccc(cc1)Cl)c1ccccc1
SPLASH splash10-00di-0090300000-2ae818abaea5085f791e
Source of Spectrum AJ-43-1655-3
Wiley ID 1594351