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N-(3,3-dichloro-1-(4-methoxyphenyl)-2-methylpropyl)aniline
SpectraBase Compound ID KwLmL5PALi
InChI InChI=1S/C17H19Cl2NO/c1-12(17(18)19)16(20-14-6-4-3-5-7-14)13-8-10-15(21-2)11-9-13/h3-12,16-17,20H,1-2H3
InChIKey UIKUKJNLBOYMIR-UHFFFAOYSA-N
Mol Weight 324.25 g/mol
Molecular Formula C17H19Cl2NO
Exact Mass 323.08437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeJENL3ZHzG
Name N-(3,3-dichloro-1-(4-methoxyphenyl)-2-methylpropyl)aniline
Appearance Colorless oil
Carrier Gas Nitrogen
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Exact Mass 323.084369635 u
Formula C17H19Cl2NO
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C17H19Cl2NO/c1-12(17(18)19)16(20-14-6-4-3-5-7-14)13-8-10-15(21-2)11-9-13/h3-12,16-17,20H,1-2H3
InChIKey UIKUKJNLBOYMIR-UHFFFAOYSA-N
Instrument Name Shimadzu 2014
Ionization Type EI
Literature Reference DOI 10.1002/chem.202203079
Molecular Weight 324.251 g/mol
Quality 117
Reported Formula C17H19Cl2NO
SMILES N(C(C(C(Cl)Cl)C)C1=CC=C(C=C1)OC)C1=CC=CC=C1
SPLASH splash10-03di-0493000000-6e6e3a1a121fb522466d
Sample Comments dr = 1:1.6
Source of Spectrum QE-29-SM5-4l (DOI: 10.1002/chem.202203079)
Wiley ID 1909404