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4-AMINO-6-[(BENZYLOXYIMINO)-METHYL]-1H-PYRAZINO-[2,3-C]-1,2,6-THIADIAZINE-2,2-DIOXIDE;Z-ISOMER
SpectraBase Compound ID DNly7pxhZcO
InChI InChI=1S/C13H12N6O3S/c14-12-11-13(19-23(20,21)18-12)15-6-10(17-11)7-16-22-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,14,18)(H,15,19)/b16-7-
InChIKey JNXNCQHLYHBAPO-APSNUPSMSA-N
Mol Weight 332.34 g/mol
Molecular Formula C13H12N6O3S
Exact Mass 332.069159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9vVzLcWyYAN
Name 4-AMINO-6-[(BENZYLOXYIMINO)-METHYL]-1H-PYRAZINO-[2,3-C]-1,2,6-THIADIAZINE-2,2-DIOXIDE;Z-ISOMER
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12N6O3S
InChI InChI=1S/C13H12N6O3S/c14-12-11-13(19-23(20,21)18-12)15-6-10(17-11)7-16-22-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,14,18)(H,15,19)/b16-7-
InChIKey JNXNCQHLYHBAPO-APSNUPSMSA-N
Literature Reference Author I.ALKORTA,P.GOYA,J.A.PAEZ
Literature Reference Citation HETEROCYCLES,32,279(1991)
Literature Reference DOI 10.3987/COM-90-5633
Molecular Weight 332.337 g/mol
Solvent DMSO-D6
Source File Reference UWGE1283