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2-MORPHOLINO-7,8-DIHYDRO-[1,2,4]-TRIAZOLO-[1,5-C]-[1,3,5]-THIADIAZEPINE-5(9H)-ONE
SpectraBase Compound ID nHfSOynPDL
InChI InChI=1S/C9H13N5OS2/c16-9-14-7(10-1-6-17-9)11-8(12-14)13-2-4-15-5-3-13/h1-6H2,(H,10,11,12)
InChIKey WISGABOXYUWFTG-UHFFFAOYSA-N
Mol Weight 271.36 g/mol
Molecular Formula C9H13N5OS2
Exact Mass 271.056152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YXIgoTyK8H
Name 2-MORPHOLINO-7,8-DIHYDRO-[1,2,4]-TRIAZOLO-[1,5-C]-[1,3,5]-THIADIAZEPINE-5(9H)-ONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N5OS2
InChI InChI=1S/C9H13N5OS2/c16-9-14-7(10-1-6-17-9)11-8(12-14)13-2-4-15-5-3-13/h1-6H2,(H,10,11,12)
InChIKey WISGABOXYUWFTG-UHFFFAOYSA-N
Literature Reference Author L.PONGO,P.SOHAR,J.REITER,P.DVORTSAK,G.BUJTAS
Literature Reference Citation J.HETCYCL.CHEM.,31,997(1994)
Literature Reference DOI 10.1002/jhet.5570310450
Molecular Weight 271.355 g/mol
Solvent DMSO-D6
Source File Reference UWCS22289