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4,4'-Methylene-bis-(N,N-bis-(2-chloroethyl)aniline)
SpectraBase Compound ID 4NPf3vncaVs
InChI InChI=1S/C21H26Cl4N2/c22-9-13-26(14-10-23)20-5-1-18(2-6-20)17-19-3-7-21(8-4-19)27(15-11-24)16-12-25/h1-8H,9-17H2
InChIKey KBGVCZSKDQMYRN-UHFFFAOYSA-N
Mol Weight 448.3 g/mol
Molecular Formula C21H26Cl4N2
Exact Mass 446.08501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6NKxn8DAvT
Name 4,4'-Methylene-bis-(N,N-bis-(2-chloroethyl)aniline)
Alternate Name(s) 4-{4-[bis(2-chloroethyl)amino]benzyl}-N,N-bis(2-chloroethyl)aniline N-(4-{4-[bis(2-chloroethyl)amino]benzyl}phenyl)-N,N-bis(2-chloroethyl)amine
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Formula C21H26Cl4N2
InChI InChI=1S/C21H26Cl4N2/c22-9-13-26(14-10-23)20-5-1-18(2-6-20)17-19-3-7-21(8-4-19)27(15-11-24)16-12-25/h1-8H,9-17H2
InChIKey KBGVCZSKDQMYRN-UHFFFAOYSA-N
Molecular Weight 448.265 g/mol
SMILES c1(N(CCCl)CCCl)ccc(cc1)Cc1ccc(cc1)N(CCCl)CCCl
SPLASH splash10-0002-5926800000-de99d7a289882dbc7ba7
Source of Spectrum RB-1982-14908-0
Wiley ID 1386506