John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=8tl8ICnqjmT SpectraBase Spectrum ID=2C02QVCPGUF

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CINCHONAIN-IA-PERACETATE
SpectraBase Compound ID 8tl8ICnqjmT
InChI InChI=1S/C36H32O15/c1-16(37)44-26-9-7-22(11-29(26)47-19(4)40)24-14-33(43)50-31-15-28(46-18(3)39)25-13-32(49-21(6)42)35(51-36(25)34(24)31)23-8-10-27(45-17(2)38)30(12-23)48-20(5)41/h7-12,15,24,32,35H,13-14H2,1-6H3/t24-,32+,35+/m0/s1
InChIKey JNYCRYLHQFBGDD-QURRDHRGSA-N
Mol Weight 704.6 g/mol
Molecular Formula C36H32O15
Exact Mass 704.174121 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2C02QVCPGUF
Name CINCHONAIN-IA-PERACETATE
Compound Number 5A
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H32O15
InChI InChI=1S/C36H32O15/c1-16(37)44-26-9-7-22(11-29(26)47-19(4)40)24-14-33(43)50-31-15-28(46-18(3)39)25-13-32(49-21(6)42)35(51-36(25)34(24)31)23-8-10-27(45-17(2)38)30(12-23)48-20(5)41/h7-12,15,24,32,35H,13-14H2,1-6H3/t24-,32+,35+/m0/s1
InChIKey JNYCRYLHQFBGDD-QURRDHRGSA-N
Literature Reference Author F.O.RESENDE,E.RODRIGUES-FILHO,H.LUFTMANN,F.PETEREID,J.C.P.D. MELLO
Literature Reference Citation J.BRAZ.CHEM.SOC.,22,2087(2011)
Literature Reference DOI 10.1590/s0103-50532011001100010
Molecular Weight 704.641 g/mol
Source File Reference UWBT5731
SpectraBase Batch ID 2GTvo1h4D7q