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CIMCXDLWRYDNBJ-UHFFFAOYSA-N

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CIMCXDLWRYDNBJ-UHFFFAOYSA-N
SpectraBase Compound ID L5FqObt8iSG
InChI InChI=1S/C27H22ClNO7S/c1-16-8-10-19(11-9-16)37(33,34)15-29-26(31)25(36-27(32)18-6-4-3-5-7-18)21-14-35-23-12-17(2)22(28)13-20(23)24(21)30/h3-14,25H,15H2,1-2H3,(H,29,31)
InChIKey CIMCXDLWRYDNBJ-UHFFFAOYSA-N
Mol Weight 539.99 g/mol
Molecular Formula C27H22ClNO7S
Exact Mass 539.080551 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BMGK5AkPLeF
Name CIMCXDLWRYDNBJ-UHFFFAOYSA-N
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H22ClNO7S
InChI InChI=1S/C27H22ClNO7S/c1-16-8-10-19(11-9-16)37(33,34)15-29-26(31)25(36-27(32)18-6-4-3-5-7-18)21-14-35-23-12-17(2)22(28)13-20(23)24(21)30/h3-14,25H,15H2,1-2H3,(H,29,31)
InChIKey CIMCXDLWRYDNBJ-UHFFFAOYSA-N
Literature Reference Author M.A.TERZIDIS,J.STEPHANIDOU-STEPAHANATOU,C.A.TSOLERIDIS
Literature Reference Citation OPEN.ORG.CHEM.J.,2,88(2008)
Literature Reference DOI 10.2174/1874095200801020088
Molecular Weight 539.987 g/mol
Solvent CDCl3
Source File Reference UWLU81065