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[TBPY-5-11]-1-ISOBUTYLOXYCARBONYLPHENYLMETHYL-3,3,3',3'-TETRAKIS-(TRIFLUOROMETHYL)-1,1'-SPIROBI-[3H,2,1,5-LAMBDA-BENZOXAPHOSPHOLE]
SpectraBase Compound ID KolC8QQqVJS
InChI InChI=1S/C31H25F12O4P/c1-18(2)16-17-45-25(44)24(19-10-4-3-5-11-19)48(22-14-8-6-12-20(22)26(46-48,28(32,33)34)29(35,36)37)23-15-9-7-13-21(23)27(47-48,30(38,39)40)31(41,42)43/h3-15,18,24H,16-17H2,1-2H3/t24-/m1/s1
InChIKey UNCBCFIROBKTOR-XMMPIXPASA-N
Mol Weight 720.49 g/mol
Molecular Formula C31H25F12O4P
Exact Mass 720.129884 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GQtM9jevxsc
Name [TBPY-5-11]-1-ISOBUTYLOXYCARBONYLPHENYLMETHYL-3,3,3',3'-TETRAKIS-(TRIFLUOROMETHYL)-1,1'-SPIROBI-[3H,2,1,5-LAMBDA-BENZOXAPHOSPHOLE]
Compound Number 13-S(P)*R*
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H25F12O4P
InChI InChI=1S/C31H25F12O4P/c1-18(2)16-17-45-25(44)24(19-10-4-3-5-11-19)48(22-14-8-6-12-20(22)26(46-48,28(32,33)34)29(35,36)37)23-15-9-7-13-21(23)27(47-48,30(38,39)40)31(41,42)43/h3-15,18,24H,16-17H2,1-2H3/t24-/m1/s1
InChIKey UNCBCFIROBKTOR-XMMPIXPASA-N
Literature Reference Author S.MATSUKAWA,A.KOJIMA,K.KAJIYAMA,Y.YAMAMOTO,K.Y.AKIBA,S.RE,S. NAGASE
Literature Reference Citation J.AM.CHEM.SOC.,124,13154(2002)
Literature Reference DOI 10.1021/ja026776c
Solvent CDCl3
Source File Reference UWLU48556