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3,7-Dihydro-3-(3-fluoro-phenyl)-7-phenyl-2,5,6-trimethyl-4H-pyrrolo(2,3-D)pyrimidin-4-imine
SpectraBase Compound ID 8gy14FcrcYT
InChI InChI=1S/C21H19FN4/c1-13-14(2)25(17-9-5-4-6-10-17)21-19(13)20(23)26(15(3)24-21)18-11-7-8-16(22)12-18/h4-12,23H,1-3H3
InChIKey VXZUHSAQXDMAKQ-UHFFFAOYSA-N
Mol Weight 346.41 g/mol
Molecular Formula C21H19FN4
Exact Mass 346.159375 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6n7Yr7EPnTU
Name 3,7-Dihydro-3-(3-fluoro-phenyl)-7-phenyl-2,5,6-trimethyl-4H-pyrrolo(2,3-D)pyrimidin-4-imine
CAS Registry Number 90774-59-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H19FN4
InChI InChI=1S/C21H19FN4/c1-13-14(2)25(17-9-5-4-6-10-17)21-19(13)20(23)26(15(3)24-21)18-11-7-8-16(22)12-18/h4-12,23H,1-3H3
InChIKey VXZUHSAQXDMAKQ-UHFFFAOYSA-N
Literature Reference A. Joergensen, N.S. Girgis, Chemica Scripta 23, 73 (1984).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3