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ZNYGSTKGMMTTFS-AJETVBGQSA-N
SpectraBase Compound ID yerDHgcFvk
InChI InChI=1S/C23H27Cl3N2O6/c1-3-21(11-34-21)15-8-18-22(14-6-4-5-7-17(14)28(31-2)19(22)29)9-16(13(15)10-32-18)27-20(30)33-12-23(24,25)26/h4-7,13,15-16,18H,3,8-12H2,1-2H3,(H,27,30)/t13-,15?,16-,18+,21-,22+/m1/s1
InChIKey ZNYGSTKGMMTTFS-AJETVBGQSA-N
Mol Weight 533.84 g/mol
Molecular Formula C23H27Cl3N2O6
Exact Mass 532.09347 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4xAB7kBxoRg
Name ZNYGSTKGMMTTFS-AJETVBGQSA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27Cl3N2O6
InChI InChI=1S/C23H27Cl3N2O6/c1-3-21(11-34-21)15-8-18-22(14-6-4-5-7-17(14)28(31-2)19(22)29)9-16(13(15)10-32-18)27-20(30)33-12-23(24,25)26/h4-7,13,15-16,18H,3,8-12H2,1-2H3,(H,27,30)/t13-,15?,16-,18+,21-,22+/m1/s1
InChIKey ZNYGSTKGMMTTFS-AJETVBGQSA-N
Literature Reference Author H.TAKAYAMA,Y.TOMINAGA,M.KITAJIMA,N.AIMI,S.I.SAKAI
Literature Reference Citation J.ORG.CHEM.,59,4381(1994)
Literature Reference DOI 10.1021/jo00095a010
Molecular Weight 533.836 g/mol
Solvent CDCl3
Source File Reference UWCP7000