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O-METHYL-S-BUTYL-N-(2-METHOXYACRIDIN-9-YL)-IMINOTHIOCARBONATE
SpectraBase Compound ID Cg1JozPKLD7
InChI InChI=1S/C20H22N2O2S/c1-4-5-12-25-20(24-3)22-19-15-8-6-7-9-17(15)21-18-11-10-14(23-2)13-16(18)19/h6-11,13H,4-5,12H2,1-3H3/b22-20+
InChIKey KVZIVFJLCVXVRB-LSDHQDQOSA-N
Mol Weight 354.47 g/mol
Molecular Formula C20H22N2O2S
Exact Mass 354.140199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KEWqJJyVm9a
Name O-METHYL-S-BUTYL-N-(2-METHOXYACRIDIN-9-YL)-IMINOTHIOCARBONATE
Compound Number 3G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N2O2S
InChI InChI=1S/C20H22N2O2S/c1-4-5-12-25-20(24-3)22-19-15-8-6-7-9-17(15)21-18-11-10-14(23-2)13-16(18)19/h6-11,13H,4-5,12H2,1-3H3/b22-20+
InChIKey KVZIVFJLCVXVRB-LSDHQDQOSA-N
Literature Reference Author P.KRISTIAN,J.BERNAT,D.MAZAGOVA,M.ANTALIK
Literature Reference Citation HETEROCYCLES,40,837(1995)
Literature Reference DOI 10.3987/COM-94-S78
Molecular Weight 354.467 g/mol
Solvent CDCl3
Source File Reference UWCP2676