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TRANS-4-(3,4-DIMETHOXYPHENYL)-2-PHENYL-4A,5,6,7,8,8A-HEXAHYDRO-2H-PHTHALAZIN-1-ONE
SpectraBase Compound ID LZ2RB53SP3S
InChI InChI=1S/C22H24N2O3/c1-26-19-13-12-15(14-20(19)27-2)21-17-10-6-7-11-18(17)22(25)24(23-21)16-8-4-3-5-9-16/h3-5,8-9,12-14,17-18H,6-7,10-11H2,1-2H3/t17-,18+/m1/s1
InChIKey NDVMSTHWOUOSMI-MSOLQXFVSA-N
Mol Weight 364.45 g/mol
Molecular Formula C22H24N2O3
Exact Mass 364.178693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AMCn3b7avlO
Name TRANS-4-(3,4-DIMETHOXYPHENYL)-2-PHENYL-4A,5,6,7,8,8A-HEXAHYDRO-2H-PHTHALAZIN-1-ONE
Compound Number 10E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24N2O3
InChI InChI=1S/C22H24N2O3/c1-26-19-13-12-15(14-20(19)27-2)21-17-10-6-7-11-18(17)22(25)24(23-21)16-8-4-3-5-9-16/h3-5,8-9,12-14,17-18H,6-7,10-11H2,1-2H3/t17-,18+/m1/s1
InChIKey NDVMSTHWOUOSMI-MSOLQXFVSA-N
Literature Reference Author M.V.D.MEY,A.HATZELMANN,I.J.V.D.LAAN,G.J.STERK,U.THIBAUT,H.TI MMERMAN
Literature Reference Citation J.MED.CHEM.,44,2511(2001)
Literature Reference DOI 10.1021/jm010837k
Molecular Weight 364.444 g/mol
Sample ID 44656
Solvent CDCl3