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7-CHLORO-3,3,5-TRIMETHYL-3H-PYRAZOLO-[3,4-D]-PYRIDAZIN-4(5H)-ONE
SpectraBase Compound ID 3VmxxvzfNMh
InChI InChI=1S/C8H9ClN4O/c1-8(2)4-5(10-12-8)6(9)11-13(3)7(4)14/h1-3H3
InChIKey VQMIJVUZAAXDNM-UHFFFAOYSA-N
Mol Weight 212.64 g/mol
Molecular Formula C8H9ClN4O
Exact Mass 212.046489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 154AgryIHt
Name 7-CHLORO-3,3,5-TRIMETHYL-3H-PYRAZOLO-[3,4-D]-PYRIDAZIN-4(5H)-ONE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9ClN4O
InChI InChI=1S/C8H9ClN4O/c1-8(2)4-5(10-12-8)6(9)11-13(3)7(4)14/h1-3H3
InChIKey VQMIJVUZAAXDNM-UHFFFAOYSA-N
Literature Reference Author A.STIMAC,B.STANOVNIK,M.TISLER
Literature Reference Citation J.HETCYCL.CHEM.,28,417(1991)
Molecular Weight 212.639 g/mol
Solvent CDCl3
Source File Reference UWCS16917