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N-(3-(2-Chloro-4-methylphenyl)propyl)aniline
SpectraBase Compound ID LWTe4AqrVod
InChI InChI=1S/C16H18ClN/c1-13-9-10-14(16(17)12-13)6-5-11-18-15-7-3-2-4-8-15/h2-4,7-10,12,18H,5-6,11H2,1H3
InChIKey XOSIHSUNAAFMRV-UHFFFAOYSA-N
Mol Weight 259.78 g/mol
Molecular Formula C16H18ClN
Exact Mass 259.112777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAp9IUrdUUP
Name N-(3-(2-Chloro-4-methylphenyl)propyl)aniline
Appearance Slightly yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18ClN
InChI InChI=1S/C16H18ClN/c1-13-9-10-14(16(17)12-13)6-5-11-18-15-7-3-2-4-8-15/h2-4,7-10,12,18H,5-6,11H2,1H3
InChIKey XOSIHSUNAAFMRV-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202001337
Molecular Weight 259.780 g/mol
Reported Formula C16H18ClN
SMILES N(CCCc1c(Cl)cc(cc1)C)c1ccccc1
SPLASH splash10-0a4i-1920000000-e6ffae633a0ec65dd99b
Source of Spectrum U1-2020-7010-49b
Thin-Layer Chromatography Rf = 0.18 (SiO2, PE/EtOAc, 30:1)
Wiley ID 1861054