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(ETA-C10H15)-(PME3)-IR-(H)-[C(O)C(CH3)2(CN)]

View entire compound with spectra: 2 NMR

(ETA-C10H15)-(PME3)-IR-(H)-[C(O)C(CH3)2(CN)]
SpectraBase Compound ID 1nkKRuJeGHe
InChI InChI=1S/C10H15.C5H6NO.C3H9P.Ir.H/c1-6-7(2)9(4)10(5)8(6)3;1-5(2,3-6)4-7;1-4(2)3;;/h1-5H3;1-2H3;1-3H3;;/q;;;-1;/p+1
InChIKey AVPUBVNRWNABLI-UHFFFAOYSA-O
Mol Weight 501.7 g/mol
Molecular Formula C18H32IrNOP
Exact Mass 502.185076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1HXTkWKcDm3
Name (ETA-C10H15)-(PME3)-IR-(H)-[C(O)C(CH3)2(CN)]
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H31IrNOP
InChI InChI=1S/C10H15.C5H6NO.C3H9P.Ir.H/c1-6-7(2)9(4)10(5)8(6)3;1-5(2,3-6)4-7;1-4(2)3;;/h1-5H3;1-2H3;1-3H3;;/q;;;-1;/p+1
InChIKey AVPUBVNRWNABLI-UHFFFAOYSA-O
Literature Reference Author J.G.CORDARO,R.G.BERGMAN
Literature Reference Citation J.AM.CHEM.SOC.,126,16912(2004)
Literature Reference DOI 10.1021/ja045859l
Molecular Weight 500.644 g/mol
Solvent C6D6
Source File Reference UWLU35216