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MQZIGYBFDRPAKN-QISQUURKSA-N
SpectraBase Compound ID 1BRC5cnlouP
InChI InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+
InChIKey MQZIGYBFDRPAKN-QISQUURKSA-N
Mol Weight 596.9 g/mol
Molecular Formula C40H52O4
Exact Mass 596.38656 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8sv0pHECYja
Name MQZIGYBFDRPAKN-QISQUURKSA-N
Compound Number 99
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H52O4
InChI InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+
InChIKey MQZIGYBFDRPAKN-QISQUURKSA-N
Literature Reference Author G.ENGLERT
Literature Reference Citation HELV.CHIM.ACTA,58,2367(1975)
Literature Reference DOI 10.1002/hlca.19750580817
Molecular Weight 596.850 g/mol
Solvent CDCl3
Source File Reference UWCS9551