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(E)-3-(8-CHLORO-2-VINYL-2,3-DIHYDRO-1H-1,5-BENZODIAZEPIN-4-YL)-4-HYDROXY-6-METHYL-2H-PYRAN-2-ONE
SpectraBase Compound ID IK4QAtYWdsM
InChI InChI=1S/C23H19ClN2O3/c1-14-11-21(27)22(23(28)29-14)20-13-17(9-7-15-5-3-2-4-6-15)25-19-12-16(24)8-10-18(19)26-20/h2-12,17,25,27H,13H2,1H3/b9-7+
InChIKey PDQOMUVJJYGERK-VQHVLOKHSA-N
Mol Weight 406.87 g/mol
Molecular Formula C23H19ClN2O3
Exact Mass 406.10842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID lPWmMAm4w2
Name (E)-3-(8-CHLORO-2-VINYL-2,3-DIHYDRO-1H-1,5-BENZODIAZEPIN-4-YL)-4-HYDROXY-6-METHYL-2H-PYRAN-2-ONE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H19ClN2O3
InChI InChI=1S/C23H19ClN2O3/c1-14-11-21(27)22(23(28)29-14)20-13-17(9-7-15-5-3-2-4-6-15)25-19-12-16(24)8-10-18(19)26-20/h2-12,17,25,27H,13H2,1H3/b9-7+
InChIKey PDQOMUVJJYGERK-VQHVLOKHSA-N
Literature Reference Author N.AIT,Y.RACHEDI,M.HAMDI,A.M.S.SILVA,F.BALEGROUNE,R.THIERRY,N .SELLIER
Literature Reference Citation J.HETCYCL.CHEM.,41,587(2004)
Literature Reference DOI 10.1002/jhet.5570410417
Molecular Weight 406.868 g/mol
Solvent CDCl3
Source File Reference UWLU22438