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CMBDILPGXOITRN-UHFFFAOYSA-N
SpectraBase Compound ID 30YIONi3cAX
InChI InChI=1S/C24H21ClN4O4S/c1-24-19-12-20(32-2)21(33-3)13-22(19)34-14-27(24)23(15-4-6-16(25)7-5-15)26-28(24)17-8-10-18(11-9-17)29(30)31/h4-13H,14H2,1-3H3
InChIKey CMBDILPGXOITRN-UHFFFAOYSA-N
Mol Weight 496.97 g/mol
Molecular Formula C24H21ClN4O4S
Exact Mass 496.097204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6UkTBTMnRBa
Name CMBDILPGXOITRN-UHFFFAOYSA-N
Compound Number 2C
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H21ClN4O4S
InChI InChI=1S/C24H21ClN4O4S/c1-24-19-12-20(32-2)21(33-3)13-22(19)34-14-27(24)23(15-4-6-16(25)7-5-15)26-28(24)17-8-10-18(11-9-17)29(30)31/h4-13H,14H2,1-3H3
InChIKey CMBDILPGXOITRN-UHFFFAOYSA-N
Literature Reference Author P.SOHAR,L.FODOR,J.SZABO,G.BERNATH
Literature Reference Citation ORG.MAGN.RES.,22,720(1984)
Literature Reference DOI 10.1002/mrc.1270221111
Molecular Weight 496.968 g/mol
Solvent CDCl3
Source File Reference UWCS11325