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5-PARA-TOLYL-8H-1,2,3,4,4A,13B-HEXAHYDROPHTHALAZINO-[1,2-B]-QUINAZOLIN-8-ONE
SpectraBase Compound ID JeMdDWYnygY
InChI InChI=1S/C22H21N3O/c1-14-10-12-15(13-11-14)20-16-6-2-3-7-17(16)21-23-19-9-5-4-8-18(19)22(26)25(21)24-20/h4-5,8-13,16-17H,2-3,6-7H2,1H3/t16-,17+/m1/s1
InChIKey WNEHVMFDLJXCLF-SJORKVTESA-N
Mol Weight 343.43 g/mol
Molecular Formula C22H21N3O
Exact Mass 343.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HImbjGSQko
Name 5-PARA-TOLYL-8H-1,2,3,4,4A,13B-HEXAHYDROPHTHALAZINO-[1,2-B]-QUINAZOLIN-8-ONE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21N3O
InChI InChI=1S/C22H21N3O/c1-14-10-12-15(13-11-14)20-16-6-2-3-7-17(16)21-23-19-9-5-4-8-18(19)22(26)25(21)24-20/h4-5,8-13,16-17H,2-3,6-7H2,1H3/t16-,17+/m1/s1
InChIKey WNEHVMFDLJXCLF-SJORKVTESA-N
Literature Reference Author G.BERNATH,F.MIKLOS,G.STAJER,P.SOHAR,Z.BOECSKEI,D.MENYHARD
Literature Reference Citation J.HETCYCL.CHEM.,35,201(1998)
Literature Reference DOI 10.1002/jhet.5570350138
Molecular Weight 343.428 g/mol
Solvent CDCl3
Source File Reference UWCS25052