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3-(DIPHENYLPHOSPHATOXY)-6-N-PHENYLPROPARGYLAMINO-2-METHYL-2-NITROHEXANE
SpectraBase Compound ID IPjok1zWKrk
InChI InChI=1S/C28H31N2O6P/c1-28(2,30(31)32)27(21-13-23-29-22-12-16-24-14-6-3-7-15-24)36-37(33,34-25-17-8-4-9-18-25)35-26-19-10-5-11-20-26/h3-11,14-15,17-20,27,29H,13,21-23H2,1-2H3
InChIKey KPQCJZHLBMSTBF-UHFFFAOYSA-N
Mol Weight 522.54 g/mol
Molecular Formula C28H31N2O6P
Exact Mass 522.191974 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1oQZrMIk4W1
Name 3-(DIPHENYLPHOSPHATOXY)-6-N-PHENYLPROPARGYLAMINO-2-METHYL-2-NITROHEXANE
Compound Number 61
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H31N2O6P
InChI InChI=1S/C28H31N2O6P/c1-28(2,30(31)32)27(21-13-23-29-22-12-16-24-14-6-3-7-15-24)36-37(33,34-25-17-8-4-9-18-25)35-26-19-10-5-11-20-26/h3-11,14-15,17-20,27,29H,13,21-23H2,1-2H3
InChIKey KPQCJZHLBMSTBF-UHFFFAOYSA-N
Literature Reference Author D.CRICH,K.RANGANATHAN,S.NEELAMKAVIL,X.HUANG
Literature Reference Citation J.AM.CHEM.SOC.,125,7942(2003)
Literature Reference DOI 10.1021/ja035639s
Solvent CDCl3
Source File Reference UWLU41672