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3-METHYL-6-(METHYLTHIO)-1-PHENYLPYRAZOLO-[4',3':5,6]-PYRANO-[2,3-D]-PYRIMIDIN-4(1H)-ONE
SpectraBase Compound ID sWZFSzwDMw
InChI InChI=1S/C16H12N4O2S/c1-9-12-14(21)13-11(8-17-16(18-13)23-2)22-15(12)20(19-9)10-6-4-3-5-7-10/h3-8H,1-2H3
InChIKey YNWISKDHHXPCHR-UHFFFAOYSA-N
Mol Weight 324.36 g/mol
Molecular Formula C16H12N4O2S
Exact Mass 324.068097 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A0oI8tOIgkB
Name 3-METHYL-6-(METHYLTHIO)-1-PHENYLPYRAZOLO-[4',3':5,6]-PYRANO-[2,3-D]-PYRIMIDIN-4(1H)-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12N4O2S
InChI InChI=1S/C16H12N4O2S/c1-9-12-14(21)13-11(8-17-16(18-13)23-2)22-15(12)20(19-9)10-6-4-3-5-7-10/h3-8H,1-2H3
InChIKey YNWISKDHHXPCHR-UHFFFAOYSA-N
Literature Reference Author G.A.ELLER,W.HOLZER
Literature Reference Citation MOLECULES,12,60(2007)
Literature Reference DOI 10.3390/12010060
Solvent CDCl3
Source File Reference UWLU46340