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5-NITRO-6-O-METHYL-2-S-METHYL-THIOIMIDOCHINOLIN
SpectraBase Compound ID 4FnihUU7WR5
InChI InChI=1S/C12H11N3O3S/c1-18-10-6-5-8-7(11(10)15(16)17)3-4-9(14-8)12(13)19-2/h3-6,13H,1-2H3
InChIKey JJONKHPITQFRPW-UHFFFAOYSA-N
Mol Weight 277.3 g/mol
Molecular Formula C12H11N3O3S
Exact Mass 277.052112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4NxAcaV1VT
Name 5-NITRO-6-O-METHYL-2-S-METHYL-THIOIMIDOCHINOLIN
CAS Registry Number 83220-11-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11N3O3S
InChI InChI=1S/C12H11N3O3S/c1-18-10-6-5-8-7(11(10)15(16)17)3-4-9(14-8)12(13)19-2/h3-6,13H,1-2H3
InChIKey JJONKHPITQFRPW-UHFFFAOYSA-N
Literature Reference Author D.L.BOGER,J.S.PANEK
Literature Reference Citation J.ORG.CHEM.,48,621(1983)
Literature Reference DOI 10.1021/jo00152a049
Molecular Weight 277.298 g/mol
Solvent DMSO-D6
Source File Reference UNIW20185