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Diphenyl [({1-[(4-Methoxyphenyl)selanyl]propan-2-yl}amino)-(o-tolyl)methyl]phosphonate
SpectraBase Compound ID 3QrnU9M1vQk
InChI InChI=1S/C30H32NO4PSe/c1-23-12-10-11-17-29(23)30(31-24(2)22-37-28-20-18-25(33-3)19-21-28)36(32,34-26-13-6-4-7-14-26)35-27-15-8-5-9-16-27/h4-21,24,30-31H,22H2,1-3H3
InChIKey MVTWCYRRKKWYAF-UHFFFAOYSA-N
Mol Weight 580.5 g/mol
Molecular Formula C30H32NO4PSe
Exact Mass 581.123418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDjESBoP7l
Name Diphenyl [({1-[(4-Methoxyphenyl)selanyl]propan-2-yl}amino)-(o-tolyl)methyl]phosphonate
Appearance Yellow oil
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Exact Mass 581.123417508 u
Formula C30H32NO4PSe
InChI InChI=1S/C30H32NO4PSe/c1-23-12-10-11-17-29(23)30(31-24(2)22-37-28-20-18-25(33-3)19-21-28)36(32,34-26-13-6-4-7-14-26)35-27-15-8-5-9-16-27/h4-21,24,30-31H,22H2,1-3H3
InChIKey MVTWCYRRKKWYAF-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701565
Molecular Weight 580.535 g/mol
Quality 52
SMILES N(C(C=1C=CC=CC1C)P(OC1=CC=CC=C1)(=O)OC1=CC=CC=C1)C(C[Se]C1=CC=C(C=C1)OC)C
SPLASH splash10-052b-1961000000-a74f8a2863809bdb2f46
Sample Comments dr = 60:40
Source of Spectrum K1-2018-636-4g (DOI: 10.1002/ejoc.201701565)
Wiley ID 1894431