For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
9,11-DIMETHYL-7-(3-TRIFLUOROMETHYLPHENYL)-IMINOPYRIMIDO-[4',5':4,5]-PYRIMIDO-[6,1-A]-AZEPIN-10,12-(9H,11H)-DIONE
SpectraBase Compound ID 1TMWVbdHv0R
InChI InChI=1S/C20H20F3N5O2/c1-26-16-15(17(29)27(2)19(26)30)14-9-4-3-5-10-28(14)18(25-16)24-13-8-6-7-12(11-13)20(21,22)23/h6-8,11H,3-5,9-10H2,1-2H3/b24-18+
InChIKey QJOOPUPSGKZMTI-HKOYGPOVSA-N
Mol Weight 419.41 g/mol
Molecular Formula C20H20F3N5O2
Exact Mass 419.156909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EkDDsGY7rqD
Name 9,11-DIMETHYL-7-(3-TRIFLUOROMETHYLPHENYL)-IMINOPYRIMIDO-[4',5':4,5]-PYRIMIDO-[6,1-A]-AZEPIN-10,12-(9H,11H)-DIONE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20F3N5O2
InChI InChI=1S/C20H20F3N5O2/c1-26-16-15(17(29)27(2)19(26)30)14-9-4-3-5-10-28(14)18(25-16)24-13-8-6-7-12(11-13)20(21,22)23/h6-8,11H,3-5,9-10H2,1-2H3/b24-18+
InChIKey QJOOPUPSGKZMTI-HKOYGPOVSA-N
Literature Reference Author H.WAMHOFF,A.SCHMIDT
Literature Reference Citation HETEROCYCLES,35,1055(1993)
Literature Reference DOI 10.3987/COM-92-S(T)102
Molecular Weight 419.406 g/mol
Solvent CDCl3
Source File Reference UWCS16507