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Pentacarbonyl[5-(6'-acetyl-5'-methylbiphenyl-3'-yl)-6-methyl-4-phenyl-2H-pyran-2-ylidene]tungsten
SpectraBase Compound ID 2J2oE42h7EE
InChI InChI=1S/C27H22O2.5CO.W/c1-18-16-23(17-25(26(18)19(2)28)22-12-8-5-9-13-22)27-20(3)29-15-14-24(27)21-10-6-4-7-11-21;5*1-2;/h4-14,16-17H,1-3H3;;;;;;
InChIKey KSJOTBYGCSXJAT-UHFFFAOYSA-N
Mol Weight 702.4 g/mol
Molecular Formula C32H22O7W
Exact Mass 702.087486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5zox3i5InDN
Name PENTACARBONYL-[5-(6'-ACETYL-5'-METHYLBIPHENYL-3'-YL)-6-METHYL-4-PHENYL-2H-PYRAN-2-YLIDENE]-TUNGSTEN
Compound Number 20B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H22O7W
InChI InChI=1S/C27H22O2.5CO.W/c1-18-16-23(17-25(26(18)19(2)28)22-12-8-5-9-13-22)27-20(3)29-15-14-24(27)21-10-6-4-7-11-21;5*1-2;/h4-14,16-17H,1-3H3;;;;;;
InChIKey KSJOTBYGCSXJAT-UHFFFAOYSA-N
Literature Reference Author R.AUMANN,A.G.MEYER,R.FROEHLICH
Literature Reference Citation J.AM.CHEM.SOC.,118,10853(1996)
Literature Reference DOI 10.1021/ja961020x
Molecular Weight 702.372 g/mol
Sample ID 53805
Solvent CDCl3