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Benzamide, N-[2-(diphenylphosphinyl)-2-(1-hydroxycyclohexyl)-1-methylethyl]-, (R*,R*)-(.+-.)-
SpectraBase Compound ID 5PfaXO8mz5a
InChI InChI=1S/C28H32NO3P/c1-22(29-27(30)23-14-6-2-7-15-23)26(28(31)20-12-5-13-21-28)33(32,24-16-8-3-9-17-24)25-18-10-4-11-19-25/h2-4,6-11,14-19,22,26,31H,5,12-13,20-21H2,1H3,(H,29,30)/t22-,26-/m1/s1
InChIKey KILQZQCUPJOFCC-ATIYNZHBSA-N
Mol Weight 461.5 g/mol
Molecular Formula C28H32NO3P
Exact Mass 461.211981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FStSHRpviBb
Name Benzamide, N-[2-(diphenylphosphinyl)-2-(1-hydroxycyclohexyl)-1-methylethyl]-, (R*,R*)-(.+-.)-
Alternate Name(s) 1-(2-Benzamido-1-diphenylphosphinoylpropyl)cyclohexanol N-[(1R,2R)-2-(diphenylphosphoryl)-2-(1-hydroxycyclohexyl)-1-methylethyl]benzamide
CAS Registry Number 114893-87-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32NO3P
InChI InChI=1S/C28H32NO3P/c1-22(29-27(30)23-14-6-2-7-15-23)26(28(31)20-12-5-13-21-28)33(32,24-16-8-3-9-17-24)25-18-10-4-11-19-25/h2-4,6-11,14-19,22,26,31H,5,12-13,20-21H2,1H3,(H,29,30)/t22-,26-/m1/s1
InChIKey KILQZQCUPJOFCC-ATIYNZHBSA-N
Molecular Weight 461.542 g/mol
SMILES N(C(=O)c1ccccc1)[C@@]([C@](C1(O)CCCCC1)(P(=O)(c1ccccc1)c1ccccc1)[H])(C)[H]
SPLASH splash10-0w2d-0092000000-b199badcd2ca09d1a4af
Source of Spectrum KC-1987-1895-27
Wiley ID 1390830