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(NC9H6O)P[(O-2,4-(TERT.-BUTYL)2C6H2)2CH2]
SpectraBase Compound ID DqzpFDSbQ3w
InChI InChI=1S/C38H50NO3P/c1-35(2,3)27-19-21-31(29(24-27)37(7,8)9)40-43(13,42-33-18-14-16-26-17-15-23-39-34(26)33)41-32-22-20-28(36(4,5)6)25-30(32)38(10,11)12/h14-25H,13H2,1-12H3
InChIKey BIQDFECZPADKTD-UHFFFAOYSA-N
Mol Weight 599.8 g/mol
Molecular Formula C38H50NO3P
Exact Mass 599.352831 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 14te4XcSRqQ
Name (NC9H6O)P[(O-2,4-(TERT.-BUTYL)2C6H2)2CH2]
Compound Number 1 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H50NO3P
InChI InChI=1S/C38H50NO3P/c1-35(2,3)27-19-21-31(29(24-27)37(7,8)9)40-43(13,42-33-18-14-16-26-17-15-23-39-34(26)33)41-32-22-20-28(36(4,5)6)25-30(32)38(10,11)12/h14-25H,13H2,1-12H3
InChIKey BIQDFECZPADKTD-UHFFFAOYSA-N
Literature Reference Author M.A.SAID,M.PUELM,R.HERBST-IRMER,K.C.K.SWAMY
Literature Reference Citation J.AM.CHEM.SOC.,118,9841(1996)
Literature Reference DOI 10.1021/ja960554v
Solvent CDCl3
Source File Reference UWLU53672