John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=ERSHFLAKDrp SpectraBase Spectrum ID=1juIAOCwWbm

(accessed ).
IR(DTBPA)(H)(COE)CL
SpectraBase Compound ID ERSHFLAKDrp
InChI InChI=1S/C28H51OP2.C8H12.ClH.Ir.H/c1-19-22(17-30(25(4,5)6)26(7,8)9)20(2)24(29-16)21(3)23(19)18-31(27(10,11)12)28(13,14)15;1-2-4-6-8-7-5-3-1;;;/h1,17-18H2,2-16H3;1-6H2;1H;;/q;;;-1;/p+1
InChIKey PHUDVPDHOCUDNX-UHFFFAOYSA-O
Mol Weight 802.5 g/mol
Molecular Formula C36H64ClIrOP2
Exact Mass 802.375039 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1juIAOCwWbm
Name IR(DTBPA)(H)(COE)CL
Compound Number 6B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H64ClIrOP2
InChI InChI=1S/C28H51OP2.C8H12.ClH.Ir.H/c1-19-22(17-30(25(4,5)6)26(7,8)9)20(2)24(29-16)21(3)23(19)18-31(27(10,11)12)28(13,14)15;1-2-4-6-8-7-5-3-1;;;/h1,17-18H2,2-16H3;1-6H2;1H;;/q;;;-1;/p+1
InChIKey PHUDVPDHOCUDNX-UHFFFAOYSA-O
Literature Reference Author B.RYBTCHINSKI,A.VIGALOK,Y.BEN-DAVID,D.MILSTEIN
Literature Reference Citation J.AM.CHEM.SOC.,118,12406(1996)
Literature Reference DOI 10.1021/ja962253r
Molecular Weight 802.524 g/mol
Sample ID 54475
Solvent C6D6
SpectraBase Batch ID JJmLoV9hJzW