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OSFYVYZZKKIFJI-RPRPRRRDSA-N
SpectraBase Compound ID Co6XaQUcICQ
InChI InChI=1S/C37H49N3O13/c1-21(41)44-20-25-27(46-22(2)42)28(47-23(3)43)26(39-40-38)35(48-25)49-30-29(45-19-24-13-7-4-8-14-24)31-33(52-36(50-31)15-9-5-10-16-36)34-32(30)51-37(53-34)17-11-6-12-18-37/h4,7-8,13-14,25-35H,5-6,9-12,15-20H2,1-3H3/t25-,26-,27-,28-,29+,30+,31-,32+,33+,34+,35-/m1/s1
InChIKey OSFYVYZZKKIFJI-RPRPRRRDSA-N
Mol Weight 743.8 g/mol
Molecular Formula C37H49N3O13
Exact Mass 743.326539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Cjt5BWTLQ0
Name OSFYVYZZKKIFJI-RPRPRRRDSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H49N3O13
InChI InChI=1S/C37H49N3O13/c1-21(41)44-20-25-27(46-22(2)42)28(47-23(3)43)26(39-40-38)35(48-25)49-30-29(45-19-24-13-7-4-8-14-24)31-33(52-36(50-31)15-9-5-10-16-36)34-32(30)51-37(53-34)17-11-6-12-18-37/h4,7-8,13-14,25-35H,5-6,9-12,15-20H2,1-3H3/t25-,26-,27-,28-,29+,30+,31-,32+,33+,34+,35-/m1/s1
InChIKey OSFYVYZZKKIFJI-RPRPRRRDSA-N
Literature Reference Author G.M.NICHOLAS,P.KOVAC,C.A.BEWLEY
Literature Reference Citation J.AM.CHEM.SOC.,124,3492(2002)
Literature Reference DOI 10.1021/ja017891a
Molecular Weight 743.808 g/mol
Sample ID 33618
Solvent CDCl3