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2-Diphenylphosphanyl-N-[(1R,2R)-2-[(2-diphenylphosphanylbenzoyl)amino]cyclohexyl]benzamide
SpectraBase Compound ID JMcV5GZXTp1
InChI InChI=1S/C44H40N2O2P2/c47-43(37-27-13-17-31-41(37)49(33-19-5-1-6-20-33)34-21-7-2-8-22-34)45-39-29-15-16-30-40(39)46-44(48)38-28-14-18-32-42(38)50(35-23-9-3-10-24-35)36-25-11-4-12-26-36/h1-14,17-28,31-32,39-40H,15-16,29-30H2,(H,45,47)(H,46,48)/t39-,40-/m1/s1
InChIKey AXMSEDAJMGFTLR-XRSDMRJBSA-N
Mol Weight 690.8 g/mol
Molecular Formula C44H40N2O2P2
Exact Mass 690.256503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcROIb14m1A
Name 2-Diphenylphosphanyl-N-[(1R,2R)-2-[(2-diphenylphosphanylbenzoyl)amino]cyclohexyl]benzamide
Alternate Name(s) 2-Diphenylphosphanyl-N-[(1R,2R)-2-[(2-diphenylphosphanylphenyl)carbonylamino]cyclohexyl]benzamide 2-Diphenylphosphino-N-[(1R,2R)-2-[[(2-diphenylphosphinophenyl)-oxomethyl]amino]cyclohexyl]benzamide
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Formula C44H40N2O2P2
InChI InChI=1S/C44H40N2O2P2/c47-43(37-27-13-17-31-41(37)49(33-19-5-1-6-20-33)34-21-7-2-8-22-34)45-39-29-15-16-30-40(39)46-44(48)38-28-14-18-32-42(38)50(35-23-9-3-10-24-35)36-25-11-4-12-26-36/h1-14,17-28,31-32,39-40H,15-16,29-30H2,(H,45,47)(H,46,48)/t39-,40-/m1/s1
InChIKey AXMSEDAJMGFTLR-XRSDMRJBSA-N
Molecular Weight 690.764 g/mol
SMILES N(C(c1c(P(c2ccccc2)c2ccccc2)cccc1)=O)[C@]1([C@](NC(c2c(P(c3ccccc3)c3ccccc3)cccc2)=O)(CCCC1)[H])[H]
SPLASH splash10-0ue9-4259001000-77bb8b9de00575148c04
Source of Spectrum QE-4-2547-3
Wiley ID 843840