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CGLGKTIJGHPLCU-VMPITWQZSA-N

View entire compound with spectra: 1 NMR

CGLGKTIJGHPLCU-VMPITWQZSA-N
SpectraBase Compound ID nmayjk714Z
InChI InChI=1S/C7H11N5O2S/c1-3-14-6(13)4-5(2)8-9-7-10-11-12-15-7/h3-4H2,1-2H3,(H,9,10,12)/b8-5+
InChIKey CGLGKTIJGHPLCU-VMPITWQZSA-N
Mol Weight 229.26 g/mol
Molecular Formula C7H11N5O2S
Exact Mass 229.063346 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2yuvwGuWikj
Name CGLGKTIJGHPLCU-VMPITWQZSA-N
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H11N5O2S
InChI InChI=1S/C7H11N5O2S/c1-3-14-6(13)4-5(2)8-9-7-10-11-12-15-7/h3-4H2,1-2H3,(H,9,10,12)/b8-5+
InChIKey CGLGKTIJGHPLCU-VMPITWQZSA-N
Literature Reference Author H.GRAUBAUM,H.SEEBOTH
Literature Reference Citation J.PRAKT.CHEM.,329,409(1987)
Literature Reference DOI 10.1002/prac.19873290306
Molecular Weight 229.257 g/mol
Solvent DMSO-D6
Source File Reference UWED9470