John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=51pmFCoNBHb SpectraBase Spectrum ID=2AajbmmKoxZ

(accessed ).
[5-ETA-C10H15(PME3)RH(ME)(NCME)]-[B(3,5-C6H3(CF3)2)4]
SpectraBase Compound ID 51pmFCoNBHb
InChI InChI=1S/C32H12BF24.C10H15.C3H9P.C2H3N.CH3.Rh/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-6-7(2)9(4)10(5)8(6)3;1-4(2)3;1-2-3;;/h1-12H;1-5H3;1-3H3;1H3;1H3;/q-1;;;;;/p+1
InChIKey QBSNYQBZGXEWSH-UHFFFAOYSA-O
Mol Weight 1233.52 g/mol
Molecular Formula C48H42BF24NPRh
Exact Mass 1233.181975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AajbmmKoxZ
Name [5-ETA-C10H15(PME3)RH(ME)(NCME)]-[B(3,5-C6H3(CF3)2)4]
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H42BF24NPRh
InChI InChI=1S/C32H12BF24.C10H15.C3H9P.C2H3N.CH3.Rh/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-6-7(2)9(4)10(5)8(6)3;1-4(2)3;1-2-3;;/h1-12H;1-5H3;1-3H3;1H3;1H3;/q-1;;;;;/p+1
InChIKey QBSNYQBZGXEWSH-UHFFFAOYSA-O
Literature Reference Author F.L.TAW,P.S.WHITE,R.G.BERGMAN,M.BROOKHART
Literature Reference Citation J.AM.CHEM.SOC.,124,4192(2002)
Literature Reference DOI 10.1021/ja0255094
Molecular Weight 1233.519 g/mol
Sample ID 49703
Solvent CD2Cl2
SpectraBase Batch ID 2fuZqEBQhcA