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LISSOClIN_A
SpectraBase Compound ID 2IZF1vmVLbU
InChI InChI=1S/C23H23N3O2S/c1-13(2)12-18(27)24-10-9-16-20-19-15(14-6-4-5-7-17(14)26-20)8-11-25-21(19)22(28)23(16)29-3/h4-8,11,13H,9-10,12H2,1-3H3,(H,24,27)
InChIKey CYSORIPWPDCIMV-UHFFFAOYSA-N
Mol Weight 405.52 g/mol
Molecular Formula C23H23N3O2S
Exact Mass 405.151098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2DR8V3TvwGT
Name LISSOClIN_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H23N3O2S
InChI InChI=1S/C23H23N3O2S/c1-13(2)12-18(27)24-10-9-16-20-19-15(14-6-4-5-7-17(14)26-20)8-11-25-21(19)22(28)23(16)29-3/h4-8,11,13H,9-10,12H2,1-3H3,(H,24,27)
InChIKey CYSORIPWPDCIMV-UHFFFAOYSA-N
Literature Reference Author P.A.SEARLE,T.F.MOLINSKI
Literature Reference Citation J.ORG.CHEM.,59,6600(1994)
Literature Reference DOI 10.1021/jo00101a018
Molecular Weight 405.515 g/mol
Solvent CDCl3
Source File Reference UWMZ2752