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(3-MORPHOLINO-5-AMINO-1H-1,2,4-TRIAZOL-1-YL)-THIOCARBONYLAMINO-ACETIC-ACID
SpectraBase Compound ID LaBkTqDccug
InChI InChI=1S/C9H14N6O3S/c10-7-12-8(14-1-3-18-4-2-14)13-15(7)9(19)11-5-6(16)17/h1-5H2,(H,11,19)(H,16,17)(H2,10,12,13)
InChIKey CXOPATIDOTUMMP-UHFFFAOYSA-N
Mol Weight 286.31 g/mol
Molecular Formula C9H14N6O3S
Exact Mass 286.08481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KCozR97KEk1
Name (3-MORPHOLINO-5-AMINO-1H-1,2,4-TRIAZOL-1-YL)-THIOCARBONYLAMINO-ACETIC-ACID
Compound Number 3/9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14N6O3S
InChI InChI=1S/C9H14N6O3S/c10-7-12-8(14-1-3-18-4-2-14)13-15(7)9(19)11-5-6(16)17/h1-5H2,(H,11,19)(H,16,17)(H2,10,12,13)
InChIKey CXOPATIDOTUMMP-UHFFFAOYSA-N
Literature Reference Author J.BARKOCZY,J.REITER
Literature Reference Citation J.HETCYCL.CHEM.,28,1597(1991)
Literature Reference DOI 10.1002/jhet.5570280624
Molecular Weight 286.309 g/mol
Solvent DMSO-D6
Source File Reference UWCP3719