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4-BENZHYDRYLIDENE-2,3,4,7,8,9,10,11-OCTAHYDRO-1-H-3A,5,11A-TRIAZABENZO-[EF]-HEPTALEN-7-ONE
SpectraBase Compound ID ExcncXMUfX9
InChI InChI=1S/C25H25N3O/c29-22-18-26-24(28-17-9-16-27-15-8-7-14-21(22)25(27)28)23(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-6,10-13,18H,7-9,14-17H2
InChIKey WQPUPBHXRUYFCW-UHFFFAOYSA-N
Mol Weight 383.5 g/mol
Molecular Formula C25H25N3O
Exact Mass 383.199762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1NXGaqsnxK
Name 4-BENZHYDRYLIDENE-2,3,4,7,8,9,10,11-OCTAHYDRO-1-H-3A,5,11A-TRIAZABENZO-[EF]-HEPTALEN-7-ONE
Compound Number IX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H25N3O
InChI InChI=1S/C25H25N3O/c29-22-18-26-24(28-17-9-16-27-15-8-7-14-21(22)25(27)28)23(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-6,10-13,18H,7-9,14-17H2
InChIKey WQPUPBHXRUYFCW-UHFFFAOYSA-N
Literature Reference Author A.F.KHLEBNIKOV,M.S.NOVIKOV,E.Y.KUSEI,J.KOPF,R.R.KOSTIKOV
Literature Reference Citation RUSS.J.ORG.CHEM.,39,559(2003)
Literature Reference DOI 10.1023/A:1026068020111
Molecular Weight 383.493 g/mol
Solvent CDCl3
Source File Reference UWMZ21666