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N-(3,3,3-trichloro-1-(4-methoxyphenyl)propyl)aniline
SpectraBase Compound ID 33acDZCc3xN
InChI InChI=1S/C16H16Cl3NO/c1-21-14-9-7-12(8-10-14)15(11-16(17,18)19)20-13-5-3-2-4-6-13/h2-10,15,20H,11H2,1H3
InChIKey FGSBLJTUYCQTBG-UHFFFAOYSA-N
Mol Weight 344.67 g/mol
Molecular Formula C16H16Cl3NO
Exact Mass 343.029747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID roMujdNMZL
Name N-(3,3,3-trichloro-1-(4-methoxyphenyl)propyl)aniline
Appearance Colorless oil
Carrier Gas Nitrogen
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Exact Mass 343.029747238 u
Formula C16H16Cl3NO
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C16H16Cl3NO/c1-21-14-9-7-12(8-10-14)15(11-16(17,18)19)20-13-5-3-2-4-6-13/h2-10,15,20H,11H2,1H3
InChIKey FGSBLJTUYCQTBG-UHFFFAOYSA-N
Instrument Name Shimadzu 2014
Ionization Type EI
Literature Reference DOI 10.1002/chem.202203079
Molecular Weight 344.669 g/mol
Quality 46
Reported Formula C16H16Cl3NO
SMILES N(C(CC(Cl)(Cl)Cl)C1=CC=C(C=C1)OC)C1=CC=CC=C1
SPLASH splash10-08fr-0493000000-e1a8cf71067173f9c9af
Source of Spectrum QE-29-SM5-4o (DOI: 10.1002/chem.202203079)
Wiley ID 1909407