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(+/-)-TRICARBONYL-[(2,3,4,5-ETA)-SPIRO-[4-METHOXY-2,4-CYCLOHEXADIENE-1,1'(3'H)-5',6'-DIMETHOXY-3'-(PHENYLETHYNYL)-ISOBENZOFURAN]]-IRON-(0)

View entire compound with spectra: 1 NMR

(+/-)-TRICARBONYL-[(2,3,4,5-ETA)-SPIRO-[4-METHOXY-2,4-CYCLOHEXADIENE-1,1'(3'H)-5',6'-DIMETHOXY-3'-(PHENYLETHYNYL)-ISOBENZOFURAN]]-IRON-(0)
SpectraBase Compound ID GPkPWmItDTj
InChI InChI=1S/C24H19O4.3CO.Fe/c1-25-18-11-13-24(14-12-18)20-16-23(27-3)22(26-2)15-19(20)21(28-24)10-9-17-7-5-4-6-8-17;3*1-2;/h4-8,15-16,21H,13H2,1-3H3;;;;/t21-,24-;;;;/m0..../s1
InChIKey WLLMPFBKTCNOLO-AFWSTIGFSA-N
Mol Weight 511.29 g/mol
Molecular Formula C27H19FeO7
Exact Mass 511.048014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ALdUMJLf7jm
Name (+/-)-TRICARBONYL-[(2,3,4,5-ETA)-SPIRO-[4-METHOXY-2,4-CYCLOHEXADIENE-1,1'(3'H)-5',6'-DIMETHOXY-3'-(PHENYLETHYNYL)-ISOBENZOFURAN]]-IRON-(0)
Compound Number 26B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H19FeO7
InChI InChI=1S/C24H19O4.3CO.Fe/c1-25-18-11-13-24(14-12-18)20-16-23(27-3)22(26-2)15-19(20)21(28-24)10-9-17-7-5-4-6-8-17;3*1-2;/h4-8,15-16,21H,13H2,1-3H3;;;;/t21-,24-;;;;/m0..../s1
InChIKey WLLMPFBKTCNOLO-AFWSTIGFSA-N
Literature Reference Author G.R.STEPHENSON,C.E.ANSON.A.V.MALKOV,C.ROE
Literature Reference Citation EUR.J.ORG.CHEM.,2012,4716(2012)
Literature Reference DOI 10.1002/ejoc.201200687
Molecular Weight 511.291 g/mol
Solvent CDCl3
Source File Reference UWLU84054