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5-METHYL-3-(3-FLUOROPHENYL)-3,7-DIHYDRO-4-H-PYRROLO-[2.3-D]-PYRIMIDIN-4-ONE
SpectraBase Compound ID zYBLpI04Tt
InChI InChI=1S/C14H12FN3O/c1-8-7-16-13-12(8)14(19)18(9(2)17-13)11-5-3-4-10(15)6-11/h3-7,16H,1-2H3
InChIKey QCWOITBIQYBDGN-UHFFFAOYSA-N
Mol Weight 257.27 g/mol
Molecular Formula C14H12FN3O
Exact Mass 257.09644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GN1IvhSx1wF
Name 5-METHYL-3-(3-FLUOROPHENYL)-3,7-DIHYDRO-4-H-PYRROLO-[2.3-D]-PYRIMIDIN-4-ONE
Compound Number 2I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12FN3O
InChI InChI=1S/C14H12FN3O/c1-8-7-16-13-12(8)14(19)18(9(2)17-13)11-5-3-4-10(15)6-11/h3-7,16H,1-2H3
InChIKey QCWOITBIQYBDGN-UHFFFAOYSA-N
Literature Reference Author K.M.H.HILMY,J.MOGENSEN,A.JORGENSEN,E.B.PEDERSEN
Literature Reference Citation HETEROCYCLES,31,367(1990)
Literature Reference DOI 10.3987/COM-89-5253
Molecular Weight 257.267 g/mol
Solvent DMSO-D6
Source File Reference UWMZ650