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Benzenemethanamine, 3,4-dichloro-.alpha.-[(2-methoxyphenyl)methylene]-N-(4-nitrophenyl)-
SpectraBase Compound ID IeqlpVrltXJ
InChI InChI=1S/C21H16Cl2N2O3/c1-28-21-5-3-2-4-15(21)13-20(14-6-11-18(22)19(23)12-14)24-16-7-9-17(10-8-16)25(26)27/h2-13,24H,1H3/b20-13+
InChIKey SWFGAYGFBUNSII-DEDYPNTBSA-N
Mol Weight 415.28 g/mol
Molecular Formula C21H16Cl2N2O3
Exact Mass 414.053798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIcCH0Q3Rwf
Name Benzenemethanamine, 3,4-dichloro-.alpha.-[(2-methoxyphenyl)methylene]-N-(4-nitrophenyl)-
Alternate Name(s) 1-(3,4-Dichlorophenyl)-1-(4-nitroanilino)-2-(2-methoxyphenyl)ethene N-[(E)-1-(3,4-dichlorophenyl)-2-(2-methoxyphenyl)ethenyl]-4-nitroaniline N-[(E)-1-(3,4-dichlorophenyl)-2-(2-methoxyphenyl)ethenyl]-N-(4-nitrophenyl)amine
CAS Registry Number 66495-71-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16Cl2N2O3
InChI InChI=1S/C21H16Cl2N2O3/c1-28-21-5-3-2-4-15(21)13-20(14-6-11-18(22)19(23)12-14)24-16-7-9-17(10-8-16)25(26)27/h2-13,24H,1H3/b20-13+
InChIKey SWFGAYGFBUNSII-DEDYPNTBSA-N
Molecular Weight 415.276 g/mol
SMILES N(\C(=C\c1c(OC)cccc1)c1cc(Cl)c(cc1)Cl)c1ccc(N(=O)=O)cc1
SPLASH splash10-02t9-0000900000-6f6452a966af653fc0fb
Source of Spectrum J-43-3064-0
Wiley ID 1375287