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2-METHYLAMINO-3-(9-ANTHRACENOYL)-5-(4-CHLOROPHENYL)-HYDROXYMETHYLEN-4,5-DIHYDRO-THIOPHENE-4-ONE
SpectraBase Compound ID KxhBLFrNIAE
InChI InChI=1S/C27H18ClNO3S/c1-29-27-22(25(32)26(33-27)23(30)15-10-12-18(28)13-11-15)24(31)21-19-8-4-2-6-16(19)14-17-7-3-5-9-20(17)21/h2-14,29-30H,1H3/b26-23+
InChIKey LLTCFZOXZQHVHF-WNAAXNPUSA-N
Mol Weight 471.96 g/mol
Molecular Formula C27H18ClNO3S
Exact Mass 471.069592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G13Ol5Fgrrt
Name 2-METHYLAMINO-3-(9-ANTHRACENOYL)-5-(4-CHLOROPHENYL)-HYDROXYMETHYLEN-4,5-DIHYDRO-THIOPHENE-4-ONE
Compound Number 8D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H18ClNO3S
InChI InChI=1S/C27H18ClNO3S/c1-29-27-22(25(32)26(33-27)23(30)15-10-12-18(28)13-11-15)24(31)21-19-8-4-2-6-16(19)14-17-7-3-5-9-20(17)21/h2-14,29-30H,1H3/b26-23+
InChIKey LLTCFZOXZQHVHF-WNAAXNPUSA-N
Literature Reference Author A.KNIESZ,M.GRUNER,R.MAYER
Literature Reference Citation MH.CHEM.,127,1173(1996)
Literature Reference DOI 10.1007/BF00844693
Molecular Weight 471.958 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWMZ192