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Diphenyl [({1-[(4-Fluorophenyl)selanyl]propan-2-yl}amino)-(o-tolyl)methyl]phosphonate
SpectraBase Compound ID FJzFMvJKmAD
InChI InChI=1S/C29H29FNO3PSe/c1-22-11-9-10-16-28(22)29(31-23(2)21-36-27-19-17-24(30)18-20-27)35(32,33-25-12-5-3-6-13-25)34-26-14-7-4-8-15-26/h3-20,23,29,31H,21H2,1-2H3
InChIKey WDIAYLQYJQUIIE-UHFFFAOYSA-N
Mol Weight 568.5 g/mol
Molecular Formula C29H29FNO3PSe
Exact Mass 569.103431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CsoDeKiOalw
Name Diphenyl [({1-[(4-Fluorophenyl)selanyl]propan-2-yl}amino)-(o-tolyl)methyl]phosphonate
Appearance Yellow oil
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Exact Mass 569.103430956 u
Formula C29H29FNO3PSe
InChI InChI=1S/C29H29FNO3PSe/c1-22-11-9-10-16-28(22)29(31-23(2)21-36-27-19-17-24(30)18-20-27)35(32,33-25-12-5-3-6-13-25)34-26-14-7-4-8-15-26/h3-20,23,29,31H,21H2,1-2H3
InChIKey WDIAYLQYJQUIIE-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701565
Molecular Weight 568.499 g/mol
Quality 46
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)F)C
SPLASH splash10-01ot-0901000000-dbc7c0533dfe567dcd21
Sample Comments dr = 55:45
Source of Spectrum K1-2018-636-4j (DOI: 10.1002/ejoc.201701565)
Wiley ID 1894434