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#7J;(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1-(4'-METHYLPHENYL)-4-(4''-CARBOMETHOXYPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZIN

View entire compound with spectra: 1 NMR

#7J;(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1-(4'-METHYLPHENYL)-4-(4''-CARBOMETHOXYPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZIN
SpectraBase Compound ID J3uCERJzRdm
InChI InChI=1S/C25H26N2O2/c1-16-8-12-18(13-9-16)24-20-6-5-7-21(20)25(27-26-24,23(24,2)3)19-14-10-17(11-15-19)22(28)29-4/h5,7-15,20-21H,6H2,1-4H3/t20-,21+,24-,25+/m1/s1
InChIKey GKFJMYNSHGVCJP-WIVXBSKCSA-N
Mol Weight 386.5 g/mol
Molecular Formula C25H26N2O2
Exact Mass 386.199428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H55pG9rN3S8
Name #7J;(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1-(4'-METHYLPHENYL)-4-(4''-CARBOMETHOXYPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26N2O2
InChI InChI=1S/C25H26N2O2/c1-16-8-12-18(13-9-16)24-20-6-5-7-21(20)25(27-26-24,23(24,2)3)19-14-10-17(11-15-19)22(28)29-4/h5,7-15,20-21H,6H2,1-4H3/t20-,21+,24-,25+/m1/s1
InChIKey GKFJMYNSHGVCJP-WIVXBSKCSA-N
Literature Reference Author W.ADAM,H.M.HARRER,W.M.NAU,K.PETERS
Literature Reference Citation J.ORG.CHEM.,59,3786(1994)
Literature Reference DOI 10.1021/jo00093a010
Molecular Weight 386.494 g/mol
Solvent CDCl3
Source File Reference UWCP6927