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[5-ETA-C5H5(CO)3W(PHCH2OCH3)]BARF4

View entire compound with spectra: 1 NMR

[5-ETA-C5H5(CO)3W(PHCH2OCH3)]BARF4
SpectraBase Compound ID 1YvizVZYHQt
InChI InChI=1S/C32H12BF24.C8H10O.C5H.3CO.W/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;1-9-7-8-5-3-2-4-6-8;1-2-4-5-3-1;3*1-2;/h1-12H;2-6H,7H2,1H3;1H;;;;/q-1;;;;;;+1
InChIKey PBMYLXGBMDJPMB-UHFFFAOYSA-N
Mol Weight 1314.32 g/mol
Molecular Formula C48H23BF24O4W
Exact Mass 1314.081548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GduGJHb6u96
Name [5-ETA-C5H5(CO)3W(PHCH2OCH3)]BARF4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H23BF24O4W
InChI InChI=1S/C32H12BF24.C8H10O.C5H.3CO.W/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;1-9-7-8-5-3-2-4-6-8;1-2-4-5-3-1;3*1-2;/h1-12H;2-6H,7H2,1H3;1H;;;;/q-1;;;;;;+1
InChIKey PBMYLXGBMDJPMB-UHFFFAOYSA-N
Literature Reference Author J.SONG,D.J.SZALDA,R.M.BULLOCK
Literature Reference Citation J.AM.CHEM.SOC.,118,11134(1996)
Literature Reference DOI 10.1021/ja962193p
Molecular Weight 1314.330 g/mol
Sample ID 52176
Solvent CD2Cl2