[(ETA(5)-C5ME5)IR(CH2CH2C(O)OME)(C2H4)](+)[B-3,5-(CF3)2C6H3](-)

SpectraBase Compound ID	6rIRsiyynZ7
InChI	InChI=1S/C32H12BF24.C10H15.C4H7O2.C2H4.Ir/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;1-3-4(5)6-2;1-2;/h1-12H;1-5H3;1,3H2,2H3;1-2H2;/q-1;;;;+1
InChIKey	IGKOBHUJRIVSOR-UHFFFAOYSA-N Google Search
Mol Weight	1305.82 g/mol
Molecular Formula	C48H38BF24IrO2
Exact Mass	1306.221086 g/mol

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SpectraBase Spectrum ID	23V2eSFhSBR
Name	[(ETA(5)-C5ME5)IR(CH2CH2C(O)OME)(C2H4)](+)[B-3,5-(CF3)2C6H3](-)
Compound Number	22
Copyright	Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C48H38BF24IrO2
InChI	InChI=1S/C32H12BF24.C10H15.C4H7O2.C2H4.Ir/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;1-3-4(5)6-2;1-2;/h1-12H;1-5H3;1,3H2,2H3;1-2H2;/q-1;;;;+1
InChIKey	IGKOBHUJRIVSOR-UHFFFAOYSA-N
Literature Reference Author	E.HAUPTMAN,S.SABO-ETIENNE,P.S.WHITE,M.BROKKHART,J.M.GARNER,P .J.FAGAN,J.C.CALABRE
Literature Reference Citation	J.AM.CHEM.SOC.,116,8038(1994)
Literature Reference DOI	10.1021/ja00097a011
Molecular Weight	1305.820 g/mol
Solvent	CD2Cl2
Source File Reference	UWSI6491