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O-METHYL-S-METHYL-(2-CHLOROACRIDIN-9-YL)-IMINOTHIOCARBONATE
SpectraBase Compound ID 3c2nYTh2QAw
InChI InChI=1S/C16H13ClN2OS/c1-20-16(21-2)19-15-11-5-3-4-6-13(11)18-14-8-7-10(17)9-12(14)15/h3-9H,1-2H3/b19-16+
InChIKey QYLGDOJOJRZPEE-KNTRCKAVSA-N
Mol Weight 316.81 g/mol
Molecular Formula C16H13ClN2OS
Exact Mass 316.043712 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lx7p614y4a1
Name O-METHYL-S-METHYL-(2-CHLOROACRIDIN-9-YL)-IMINOTHIOCARBONATE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13ClN2OS
InChI InChI=1S/C16H13ClN2OS/c1-20-16(21-2)19-15-11-5-3-4-6-13(11)18-14-8-7-10(17)9-12(14)15/h3-9H,1-2H3/b19-16+
InChIKey QYLGDOJOJRZPEE-KNTRCKAVSA-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 316.805 g/mol
Solvent CDCl3
Source File Reference UWCP2673