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ALPHA-(4-MERCAPTO-1-PHENYLPYRAZOLO-[3,4-D]-PYRIMIDIN-6-YLTHIO)-PROPIONAMIDE
SpectraBase Compound ID Fmrovsk44GU
InChI InChI=1S/C14H13N5OS2/c1-8(11(15)20)22-14-17-12-10(13(21)18-14)7-16-19(12)9-5-3-2-4-6-9/h2-8H,1H3,(H2,15,20)(H,17,18,21)
InChIKey JPRFYUUMAUZELG-UHFFFAOYSA-N
Mol Weight 331.41 g/mol
Molecular Formula C14H13N5OS2
Exact Mass 331.056152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7F0p1Lk0WRX
Name ALPHA-(4-MERCAPTO-1-PHENYLPYRAZOLO-[3,4-D]-PYRIMIDIN-6-YLTHIO)-PROPIONAMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13N5OS2
InChI InChI=1S/C14H13N5OS2/c1-8(11(15)20)22-14-17-12-10(13(21)18-14)7-16-19(12)9-5-3-2-4-6-9/h2-8H,1H3,(H2,15,20)(H,17,18,21)
InChIKey JPRFYUUMAUZELG-UHFFFAOYSA-N
Literature Reference Author R.J.QUINN,P.J.SCAMMELLS,D.J.TUCKER
Literature Reference Citation AUSTR.J.CHEM.,44,753(1991)
Literature Reference DOI 10.1071/ch9910753
Molecular Weight 331.410 g/mol
Solvent DMSO-D6
Source File Reference UWED14076