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5-PARA-TOLYL-9,12-METHANO-8H-1,2,3,4,4A,8A,9,10,11,12,13,13A-DODECAHYDROPHTHALAZINO-[1,2-B]-QUINAZOLIN-8-ONE
SpectraBase Compound ID FsIKQ9H9yB
InChI InChI=1S/C23H27N3O/c1-13-6-8-14(9-7-13)20-17-4-2-3-5-18(17)22-24-21-16-11-10-15(12-16)19(21)23(27)26(22)25-20/h6-9,15-19,21H,2-5,10-12H2,1H3/t15-,16+,17+,18-,19+,21-/m1/s1
InChIKey SXFHMCQMDXTATH-REBNMZDTSA-N
Mol Weight 361.49 g/mol
Molecular Formula C23H27N3O
Exact Mass 361.215413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LxqRi7Rfxax
Name 5-PARA-TOLYL-9,12-METHANO-8H-1,2,3,4,4A,8A,9,10,11,12,13,13A-DODECAHYDROPHTHALAZINO-[1,2-B]-QUINAZOLIN-8-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27N3O
InChI InChI=1S/C23H27N3O/c1-13-6-8-14(9-7-13)20-17-4-2-3-5-18(17)22-24-21-16-11-10-15(12-16)19(21)23(27)26(22)25-20/h6-9,15-19,21H,2-5,10-12H2,1H3/t15-,16+,17+,18-,19+,21-/m1/s1
InChIKey SXFHMCQMDXTATH-REBNMZDTSA-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 361.487 g/mol
Solvent CDCl3
Source File Reference UWCS25058