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1-[2-(4-chlorophenyl)-3-[4-[(4-chlorophenyl)methoxy]phenyl]-4-(3-methoxyphenyl)-3H-1,2,4-triazol-5-yl]ethanone
SpectraBase Compound ID IQmkyUXdUBx
InChI InChI=1S/C30H25Cl2N3O3/c1-20(36)29-33-35(25-14-12-24(32)13-15-25)30(34(29)26-4-3-5-28(18-26)37-2)22-8-16-27(17-9-22)38-19-21-6-10-23(31)11-7-21/h3-18,30H,19H2,1-2H3
InChIKey ZKQXIRNBNPWODY-UHFFFAOYSA-N
Mol Weight 546.45 g/mol
Molecular Formula C30H25Cl2N3O3
Exact Mass 545.127297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xGJr13HDTn
Name 1-[2-(4-chlorophenyl)-3-[4-[(4-chlorophenyl)methoxy]phenyl]-4-(3-methoxyphenyl)-3H-1,2,4-triazol-5-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H25Cl2N3O3
InChI InChI=1S/C30H25Cl2N3O3/c1-20(36)29-33-35(25-14-12-24(32)13-15-25)30(34(29)26-4-3-5-28(18-26)37-2)22-8-16-27(17-9-22)38-19-21-6-10-23(31)11-7-21/h3-18,30H,19H2,1-2H3
InChIKey ZKQXIRNBNPWODY-UHFFFAOYSA-N
Molecular Weight 546.454 g/mol
SMILES COc1cc(N2C(=NN(C2c2ccc(OCc3ccc(cc3)Cl)cc2)c2ccc(cc2)Cl)C(=O)C)ccc1
SPLASH splash10-004i-3914020000-1f28d7b10091513e0082
Synonyms 1-[3-[4-(4-chlorobenzyl)oxyphenyl]-2-(4-chlorophenyl)-4-(3-methoxyphenyl)-3H-1,2,4-triazol-5-yl]ethanone
Wiley ID 1437385