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Dibutyl 4-bromo-a-(4-methoxyanilino)benzylphosphonate
SpectraBase Compound ID GlbxLuJeIMw
InChI InChI=1S/C22H31BrNO4P/c1-4-6-16-27-29(25,28-17-7-5-2)22(18-8-10-19(23)11-9-18)24-20-12-14-21(26-3)15-13-20/h8-15,22,24H,4-7,16-17H2,1-3H3
InChIKey ZGCNTZBGHYHRGB-UHFFFAOYSA-N
Mol Weight 484.37 g/mol
Molecular Formula C22H31BrNO4P
Exact Mass 483.117408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZQz4GbSwjX
Name Dibutyl 4-bromo-a-(4-methoxyanilino)benzylphosphonate
Alternate Name(s) Dibutyl (4-bromophenyl)(4-methoxyanilino)methylphosphonate N-[(4-bromophenyl)-dibutoxyphosphoryl-methyl]-4-methoxy-aniline [(4-bromophenyl)-dibutoxyphosphoryl-methyl]-(4-methoxyphenyl)amine
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Formula C22H31BrNO4P
InChI InChI=1S/C22H31BrNO4P/c1-4-6-16-27-29(25,28-17-7-5-2)22(18-8-10-19(23)11-9-18)24-20-12-14-21(26-3)15-13-20/h8-15,22,24H,4-7,16-17H2,1-3H3
InChIKey ZGCNTZBGHYHRGB-UHFFFAOYSA-N
Molecular Weight 484.371 g/mol
SMILES N(C(c1ccc(cc1)Br)P(=O)(OCCCC)OCCCC)c1ccc(cc1)OC
SPLASH splash10-0006-7629000000-23e9e6e496ba75e069a1
Wiley ID 1470052