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FERRUGINYL-IBUPROFENATE
SpectraBase Compound ID 2IXCBIoteQL
InChI InChI=1S/C33H46O2/c1-21(2)18-24-10-12-25(13-11-24)23(5)31(34)35-29-20-28-26(19-27(29)22(3)4)14-15-30-32(6,7)16-9-17-33(28,30)8/h10-13,19-23,30H,9,14-18H2,1-8H3/t23-,30?,33+/m0/s1
InChIKey MJFHQQODZBATJV-YBDNVGNYSA-N
Mol Weight 474.7 g/mol
Molecular Formula C33H46O2
Exact Mass 474.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ACqT38zNdI8
Name FERRUGINYL-IBUPROFENATE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H46O2
InChI InChI=1S/C33H46O2/c1-21(2)18-24-10-12-25(13-11-24)23(5)31(34)35-29-20-28-26(19-27(29)22(3)4)14-15-30-32(6,7)16-9-17-33(28,30)8/h10-13,19-23,30H,9,14-18H2,1-8H3/t23-,30?,33+/m0/s1
InChIKey MJFHQQODZBATJV-YBDNVGNYSA-N
Literature Reference Author C.THEODULOZ,C.DELPORTE,G.VALENZUELA-BARRA,X.SILVA,S.CADIZ,F. BUSTAMANTE,M.W.PERTI
Literature Reference Citation MOLECULES,20,11219(2015)
Literature Reference DOI 10.3390/molecules200611219
Molecular Weight 474.727 g/mol
Solvent CDCl3
Source File Reference UWPA3230