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[1-(N-p-Bromophenylamino)]-[1-(p-anisyl)methyl]phosphonous acid-borane diisopropyl ester
SpectraBase Compound ID CnV3RKDPq56
InChI InChI=1S/C20H27BrNO3P.BH3/c1-14(2)24-26(25-15(3)4)20(16-6-12-19(23-5)13-7-16)22-18-10-8-17(21)9-11-18;/h6-15,20,22H,1-5H3;1H3
InChIKey JBJXZQMWJFIUHV-UHFFFAOYSA-N
Mol Weight 454.15 g/mol
Molecular Formula C20H30BBrNO3P
Exact Mass 453.123974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHNaWNDgVRX
Name [1-(N-p-Bromophenylamino)]-[1-(p-anisyl)methyl]phosphonous acid-borane diisopropyl ester
Appearance Oil
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Formula C20H30BBrNO3P
InChI InChI=1S/C20H27BrNO3P.BH3/c1-14(2)24-26(25-15(3)4)20(16-6-12-19(23-5)13-7-16)22-18-10-8-17(21)9-11-18;/h6-15,20,22H,1-5H3;1H3
InChIKey JBJXZQMWJFIUHV-UHFFFAOYSA-N
Instrument Name Shimadzu GC??MS QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801518
Molecular Weight 454.152 g/mol
SMILES B.N(c1ccc(Br)cc1)C(c1ccc(cc1)OC)P(OC(C)C)OC(C)C
SPLASH splash10-000f-0290000000-b1d8531af4e7241ab656
Source of Spectrum U1-2019-935-23f
Thin-Layer Chromatography Rf = 0.89 (hexane/AcOEt, 2:1)
Wiley ID 1843708