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4-(4-Chlorophenyl)-2-methyl-6-[4-(2-methoxyphenyl)piperazinyl-1-yl]benzonitrile
SpectraBase Compound ID 3ZeHGWmUCze
InChI InChI=1S/C25H24ClN3O/c1-18-15-20(19-7-9-21(26)10-8-19)16-24(22(18)17-27)29-13-11-28(12-14-29)23-5-3-4-6-25(23)30-2/h3-10,15-16H,11-14H2,1-2H3
InChIKey HLZUQUUBOUTDKM-UHFFFAOYSA-N
Mol Weight 417.94 g/mol
Molecular Formula C25H24ClN3O
Exact Mass 417.16079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4sjsSh0CEAq
Name 4-(4-Chlorophenyl)-2-methyl-6-[4-(2-methoxyphenyl)piperazinyl-1-yl]benzonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C25H24ClN3O
InChI InChI=1S/C25H24ClN3O/c1-18-15-20(19-7-9-21(26)10-8-19)16-24(22(18)17-27)29-13-11-28(12-14-29)23-5-3-4-6-25(23)30-2/h3-10,15-16H,11-14H2,1-2H3
InChIKey HLZUQUUBOUTDKM-UHFFFAOYSA-N
Molecular Weight 417.940 g/mol
SMILES c1(c(c(C)cc(c1)-c1ccc(cc1)Cl)C#N)N1CCN(CC1)c1c(OC)cccc1
SPLASH splash10-014i-0000900000-fedc6965894c4626377b
Source of Spectrum K-2001-1958-6
Synonyms 4'-chloro-3-[4-(2-methoxyphenyl)-1-piperazinyl]-5-methyl[1,1'-biphenyl]-4-carbonitrile 4-(4-chlorophenyl)-2-[4-(2-methoxyphenyl)-1-piperazinyl]-6-methylbenzonitrile 4-(4-chlorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-6-methylbenzonitrile 4-(4-chlorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-6-methyl-benzonitrile 4-(4-chlorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-6-methyl-benzenecarbonitrile
Wiley ID 1579549