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N-(1,5-Bis(2-chlorophenyl)pentan-3-yl)-3,5-dimethylaniline
SpectraBase Compound ID BUSLaJlM7kK
InChI InChI=1S/C25H27Cl2N/c1-18-15-19(2)17-23(16-18)28-22(13-11-20-7-3-5-9-24(20)26)14-12-21-8-4-6-10-25(21)27/h3-10,15-17,22,28H,11-14H2,1-2H3
InChIKey WHKQEAVCWLWJRV-UHFFFAOYSA-N
Mol Weight 412.4 g/mol
Molecular Formula C25H27Cl2N
Exact Mass 411.152055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDw0aF08jPE
Name N-(1,5-Bis(2-chlorophenyl)pentan-3-yl)-3,5-dimethylaniline
Appearance Colorless solid
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Formula C25H27Cl2N
InChI InChI=1S/C25H27Cl2N/c1-18-15-19(2)17-23(16-18)28-22(13-11-20-7-3-5-9-24(20)26)14-12-21-8-4-6-10-25(21)27/h3-10,15-17,22,28H,11-14H2,1-2H3
InChIKey WHKQEAVCWLWJRV-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202001337
Molecular Weight 412.404 g/mol
Reported Formula C25H27Cl2N
SMILES N(C(CCc1c(Cl)cccc1)CCc1c(cccc1)Cl)c1cc(cc(c1)C)C
SPLASH splash10-00di-1490100000-0790ae0f4d2d4683f45c
Source of Spectrum U1-2020-7006-29c
Thin-Layer Chromatography Rf = 0.32 (SiO2, PE/EtOAc, 30:1)
Wiley ID 1861029