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6-AMINO-4-(4-METHOXYPHENYL)-2-PHENYL-2,3-DIHYDRO-(1H)-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPINE
SpectraBase Compound ID 9R91eZLesL9
InChI InChI=1S/C20H19N5O/c1-26-15-9-7-14(8-10-15)16-11-17(13-5-3-2-4-6-13)25-20-18(24-16)19(21)22-12-23-20/h2-10,12,17H,11H2,1H3,(H3,21,22,23,25)
InChIKey IYEWKXBAZJCDMP-UHFFFAOYSA-N
Mol Weight 345.41 g/mol
Molecular Formula C20H19N5O
Exact Mass 345.15896 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8QaOQgRkTrA
Name 6-AMINO-4-(4-METHOXYPHENYL)-2-PHENYL-2,3-DIHYDRO-(1H)-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPINE
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19N5O
InChI InChI=1S/C20H19N5O/c1-26-15-9-7-14(8-10-15)16-11-17(13-5-3-2-4-6-13)25-20-18(24-16)19(21)22-12-23-20/h2-10,12,17H,11H2,1H3,(H3,21,22,23,25)
InChIKey IYEWKXBAZJCDMP-UHFFFAOYSA-N
Literature Reference Author B.INSUASTY,A.PEREZ,J.VALENCIA,J.QUIROGA
Literature Reference Citation J.HETCYCL.CHEM.,34,1555(1997)
Literature Reference DOI 10.1002/jhet.5570340528
Molecular Weight 345.404 g/mol
Solvent DMSO-D6
Source File Reference UWSW562