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1,4-METHANO-5-PARA-TOLYL-8H-1,2,3,4,4A,13B-HEXAHYDROPHTHALAZINO-[1,2-B]-QUINAZOLIN-8-ONE
SpectraBase Compound ID K9aTvioGRyc
InChI InChI=1S/C23H21N3O/c1-13-6-8-14(9-7-13)21-19-15-10-11-16(12-15)20(19)22-24-18-5-3-2-4-17(18)23(27)26(22)25-21/h2-9,15-16,19-20H,10-12H2,1H3/t15-,16+,19-,20+/m0/s1
InChIKey NREAEMODXXUESU-ACZWYYKOSA-N
Mol Weight 355.44 g/mol
Molecular Formula C23H21N3O
Exact Mass 355.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ErGSWCmLub4
Name 1,4-METHANO-5-PARA-TOLYL-8H-1,2,3,4,4A,13B-HEXAHYDROPHTHALAZINO-[1,2-B]-QUINAZOLIN-8-ONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H21N3O
InChI InChI=1S/C23H21N3O/c1-13-6-8-14(9-7-13)21-19-15-10-11-16(12-15)20(19)22-24-18-5-3-2-4-17(18)23(27)26(22)25-21/h2-9,15-16,19-20H,10-12H2,1H3/t15-,16+,19-,20+/m0/s1
InChIKey NREAEMODXXUESU-ACZWYYKOSA-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 355.439 g/mol
Solvent CDCl3
Source File Reference UWCS25053