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(1A,4A,4A-ALPHA,7A-ALPHA)-4,4A,5,6,7,7A-HEXAHYDRO-8,8-DIMETHYL-1-(2'-METHYLPHENYL)-4-PHENYL-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
SpectraBase Compound ID 5yN5PA8FN8e
InChI InChI=1S/C23H26N2/c1-16-10-7-8-13-18(16)23-20-15-9-14-19(20)22(24-25-23,21(23,2)3)17-11-5-4-6-12-17/h4-8,10-13,19-20H,9,14-15H2,1-3H3/t19?,20-,22-,23+/m0/s1
InChIKey DYCSLTSPMJVJJL-AADSMUJASA-N
Mol Weight 330.48 g/mol
Molecular Formula C23H26N2
Exact Mass 330.209599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1D14sEmlx7o
Name (1A,4A,4A-ALPHA,7A-ALPHA)-4,4A,5,6,7,7A-HEXAHYDRO-8,8-DIMETHYL-1-(2'-METHYLPHENYL)-4-PHENYL-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
Compound Number 1E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26N2
InChI InChI=1S/C23H26N2/c1-16-10-7-8-13-18(16)23-20-15-9-14-19(20)22(24-25-23,21(23,2)3)17-11-5-4-6-12-17/h4-8,10-13,19-20H,9,14-15H2,1-3H3/t19?,20-,22-,23+/m0/s1
InChIKey DYCSLTSPMJVJJL-AADSMUJASA-N
Literature Reference Author W.ADAM,C.VANBARNEVELD,J.S.GERKE,F.G.KLAERNER
Literature Reference Citation J.CHEM.SOC.PERKIN-2,2723(1999)
Literature Reference DOI 10.1039/a905773k
Molecular Weight 330.473 g/mol
Solvent CDCl3
Source File Reference UWRU11083