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N-[1-(3-ACETYLAMINO-6,8-DIBROMO-4-OXO-3,4-DIHYDRO-QUINAZOLIN-2-YL)-2-(2-CHLOROPHENYL)-VINYL]-BENZAMIDE
SpectraBase Compound ID AAd6M3whVVL
InChI InChI=1S/C25H17Br2ClN4O3/c1-14(33)31-32-23(30-22-18(25(32)35)12-17(26)13-19(22)27)21(11-16-9-5-6-10-20(16)28)29-24(34)15-7-3-2-4-8-15/h2-13H,1H3,(H,29,34)(H,31,33)/b21-11-
InChIKey WWHBBFUQWOMPPO-NHDPSOOVSA-N
Mol Weight 616.7 g/mol
Molecular Formula C25H17Br2ClN4O3
Exact Mass 613.935594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JdfMmAVkdzG
Name N-[1-(3-ACETYLAMINO-6,8-DIBROMO-4-OXO-3,4-DIHYDRO-QUINAZOLIN-2-YL)-2-(2-CHLOROPHENYL)-VINYL]-BENZAMIDE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H17Br2ClN4O3
InChI InChI=1S/C25H17Br2ClN4O3/c1-14(33)31-32-23(30-22-18(25(32)35)12-17(26)13-19(22)27)21(11-16-9-5-6-10-20(16)28)29-24(34)15-7-3-2-4-8-15/h2-13H,1H3,(H,29,34)(H,31,33)/b21-11-
InChIKey WWHBBFUQWOMPPO-NHDPSOOVSA-N
Literature Reference Author T.M.ABDEL-RAHMAN
Literature Reference Citation J.HETCYCL.CHEM.,43,527(2006)
Literature Reference DOI 10.1002/jhet.5570430302
Molecular Weight 616.696 g/mol
Sample ID 41746
Solvent DMSO-D6