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3-ETHYLCARBOXYLATE-2-METHYL-6H-[1]-BENZOPYRANO-[3,4-E]-PYRAZOLO-[1,5-A]-PYRIMIDIN-6-ONE
SpectraBase Compound ID K2ybZQm4wvh
InChI InChI=1S/C17H13N3O4/c1-3-23-17(22)13-9(2)19-20-14-10-6-4-5-7-12(10)24-16(21)11(14)8-18-15(13)20/h4-8H,3H2,1-2H3
InChIKey KDHOONXYROTBBL-UHFFFAOYSA-N
Mol Weight 323.31 g/mol
Molecular Formula C17H13N3O4
Exact Mass 323.090606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBiRirV7qi8
Name 3-ETHYLCARBOXYLATE-2-METHYL-6H-[1]-BENZOPYRANO-[3,4-E]-PYRAZOLO-[1,5-A]-PYRIMIDIN-6-ONE
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13N3O4
InChI InChI=1S/C17H13N3O4/c1-3-23-17(22)13-9(2)19-20-14-10-6-4-5-7-12(10)24-16(21)11(14)8-18-15(13)20/h4-8H,3H2,1-2H3
InChIKey KDHOONXYROTBBL-UHFFFAOYSA-N
Literature Reference Author R.GHARBI,A.ROMDHANE,Z.MIGHRI,M.T.MARTIN
Literature Reference Citation J.HETCYCL.CHEM.,42,169(2005)
Literature Reference DOI 10.1002/jhet.5570420128
Molecular Weight 323.308 g/mol
Sample ID 42358
Solvent DMSO-D6