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OEFVZQAEXMNDIJ-GRNUSDKPSA-N
SpectraBase Compound ID 8kYejWKBHYY
InChI InChI=1S/C41H53Cl3N2O25/c1-9-11-56-38(53)45-26-31(64-21(7)51)28(62-19(5)49)23(13-58-17(3)47)66-35(26)69-33-30(71-40(55)61-16-41(42,43)44)25-15-60-37(68-25)34(33)70-36-27(46-39(54)57-12-10-2)32(65-22(8)52)29(63-20(6)50)24(67-36)14-59-18(4)48/h9-10,23-37H,1-2,11-16H2,3-8H3,(H,45,53)(H,46,54)/t23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33+,34+,35+,36+,37-/m1/s1
InChIKey OEFVZQAEXMNDIJ-GRNUSDKPSA-N
Mol Weight 1080.2 g/mol
Molecular Formula C41H53Cl3N2O25
Exact Mass 1078.200298 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cn2EaiT1N7Z
Name OEFVZQAEXMNDIJ-GRNUSDKPSA-N
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H53Cl3N2O25
InChI InChI=1S/C41H53Cl3N2O25/c1-9-11-56-38(53)45-26-31(64-21(7)51)28(62-19(5)49)23(13-58-17(3)47)66-35(26)69-33-30(71-40(55)61-16-41(42,43)44)25-15-60-37(68-25)34(33)70-36-27(46-39(54)57-12-10-2)32(65-22(8)52)29(63-20(6)50)24(67-36)14-59-18(4)48/h9-10,23-37H,1-2,11-16H2,3-8H3,(H,45,53)(H,46,54)/t23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33+,34+,35+,36+,37-/m1/s1
InChIKey OEFVZQAEXMNDIJ-GRNUSDKPSA-N
Literature Reference Author D.LAFONT,S.MANAUDIER,P.BOULLANGER,G.DESCOTES
Literature Reference Citation BULL.SOC.CHIM.FR.,127,576(1990)
Molecular Weight 1080.229 g/mol
Solvent ACETONE-D6
Source File Reference UWSK2971