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[(1RS,7SR)-2-ETHYL-4,4-DIMETHYL-2-AZABENZO-[8,9]-TRICYCLO-[5.2.2.0]-UNDECAN-5,8,10-ONE)-TRICARBONYLIRON
SpectraBase Compound ID 6ZW24agBKfr
InChI InChI=1S/C18H19NO.3CO.Fe/c1-4-19-16(20)17(2,3)15-11-12-9-10-18(15,19)14-8-6-5-7-13(12)14;3*1-2;/h5-12H,4H2,1-3H3;;;;/t12-,18+;;;;/m1..../s1
InChIKey FSBJREODOXVNMM-MHPHCWHHSA-N
Mol Weight 405.23 g/mol
Molecular Formula C21H19FeNO4
Exact Mass 405.066344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtFghJYXHRx
Name [(1RS,7SR)-2-ETHYL-4,4-DIMETHYL-2-AZABENZO-[8,9]-TRICYCLO-[5.2.2.0]-UNDECAN-5,8,10-ONE)-TRICARBONYLIRON
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19FeNO4
InChI InChI=1S/C18H19NO.3CO.Fe/c1-4-19-16(20)17(2,3)15-11-12-9-10-18(15,19)14-8-6-5-7-13(12)14;3*1-2;/h5-12H,4H2,1-3H3;;;;/t12-,18+;;;;/m1..../s1
InChIKey FSBJREODOXVNMM-MHPHCWHHSA-N
Literature Reference Author L.S.TRIFONOV,A.S.ORAHOVATS
Literature Reference Citation HELV.CHIM.ACTA,72,648(1989)
Literature Reference DOI 10.1002/hlca.19890720404
Molecular Weight 405.233 g/mol
Solvent CDCl3
Source File Reference UWED211665