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(M,1'R,4'R)+(P,1'S,4'S)-2,18-(1,4-Dimeo-bu-1,4-diyl)-8,12-bis(2-meo- carbonyl-et)-3,7,13,17-tetra-me-1,19-bilindione
SpectraBase Compound ID GZh7TGCGVEO
InChI InChI=1S/C37H44N4O8/c1-18-22(9-13-32(42)48-7)28-17-29-23(10-14-33(43)49-8)19(2)25(39-29)16-27-21(4)35(37(45)41-27)31(47-6)12-11-30(46-5)34-20(3)26(40-36(34)44)15-24(18)38-28/h15-17,30-31,38H,9-14H2,1-8H3,(H,40,44)(H,41,45)/b26-15-,27-16-,29-17-
InChIKey GVQHGNJOJXYJRK-DVENXXFFSA-N
Mol Weight 672.8 g/mol
Molecular Formula C37H44N4O8
Exact Mass 672.315914 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FVO6cXMHfFo
Name (M,1'R,4'R)+(P,1'S,4'S)-2,18-(1,4-Dimeo-bu-1,4-diyl)-8,12-bis(2-meo- carbonyl-et)-3,7,13,17-tetra-me-1,19-bilindione
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Formula C37H44N4O8
InChI InChI=1S/C37H44N4O8/c1-18-22(9-13-32(42)48-7)28-17-29-23(10-14-33(43)49-8)19(2)25(39-29)16-27-21(4)35(37(45)41-27)31(47-6)12-11-30(46-5)34-20(3)26(40-36(34)44)15-24(18)38-28/h15-17,30-31,38H,9-14H2,1-8H3,(H,40,44)(H,41,45)/b26-15-,27-16-,29-17-
InChIKey GVQHGNJOJXYJRK-DVENXXFFSA-N
Instrument Name Bruker WM-250
Literature Reference D. Krois, H. Lehner, J. Chem. Soc. Perkin I 2179 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3