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SHLMEXMGRFOMCY-ZRDIBKRKSA-N
SpectraBase Compound ID E1AXnIg4ndT
InChI InChI=1S/C14H13N3O2S/c1-19-14(18)12(8-17)10-4-3-5-11(10)13(20-2)9(6-15)7-16/h11H,3-5H2,1-2H3/b12-10+
InChIKey SHLMEXMGRFOMCY-ZRDIBKRKSA-N
Mol Weight 287.34 g/mol
Molecular Formula C14H13N3O2S
Exact Mass 287.072848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5T9KeIEhvyW
Name SHLMEXMGRFOMCY-ZRDIBKRKSA-N
Compound Number 4,N=1,EXO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13N3O2S
InChI InChI=1S/C14H13N3O2S/c1-19-14(18)12(8-17)10-4-3-5-11(10)13(20-2)9(6-15)7-16/h11H,3-5H2,1-2H3/b12-10+
InChIKey SHLMEXMGRFOMCY-ZRDIBKRKSA-N
Literature Reference Author E.KLEINPETER,M.HEYDENREICH,J.WOLLER,G.WOLF,A.KOCH,G.KEMPTER, K.PIHLAJA
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1877(1998)
Literature Reference DOI 10.1039/a803732i
Molecular Weight 287.336 g/mol
Solvent CDCl3
Source File Reference UWRU10131