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5-THIOXO-CHROMENO-[4,3-D]-[1,2,3]-TRIAZEPIN-6(5H)-ONE
SpectraBase Compound ID AxpIE5Xd49h
InChI InChI=1S/C11H5N3O2S/c15-11-9-8(17)5-12-14-13-10(9)6-3-1-2-4-7(6)16-11/h1-5H
InChIKey JSOXSQRNFSTOEU-UHFFFAOYSA-N
Mol Weight 243.24 g/mol
Molecular Formula C11H5N3O2S
Exact Mass 243.010248 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3jhQLqvOvSk
Name 5-THIOXO-CHROMENO-[4,3-D]-[1,2,3]-TRIAZEPIN-6(5H)-ONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H5N3O2S
InChI InChI=1S/C11H5N3O2S/c15-11-9-8(17)5-12-14-13-10(9)6-3-1-2-4-7(6)16-11/h1-5H
InChIKey JSOXSQRNFSTOEU-UHFFFAOYSA-N
Literature Reference Author S.S.MAIGALI,M.A.A.E.MAKSOUD,F.M.SOLIMAN
Literature Reference Citation J.CHEM.SCI.,125,1419(2013)
Literature Reference DOI 10.1007/s12039-013-0496-5
Molecular Weight 243.240 g/mol
Solvent DMSO-D6
Source File Reference UWBT11402