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(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1,4-BIS-(4'-CHLOROPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE

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(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1,4-BIS-(4'-CHLOROPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
SpectraBase Compound ID 6u6IlmaveWB
InChI InChI=1S/C22H20Cl2N2/c1-20(2)21(14-6-10-16(23)11-7-14)18-4-3-5-19(18)22(20,26-25-21)15-8-12-17(24)13-9-15/h3-4,6-13,18-19H,5H2,1-2H3/t18-,19+,21-,22+/m1/s1
InChIKey VAKKVZTZVIGLRB-KIZRIRGWSA-N
Mol Weight 383.32 g/mol
Molecular Formula C22H20Cl2N2
Exact Mass 382.100354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1v2Xgg559Qc
Name (1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1,4-BIS-(4'-CHLOROPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
Compound Number 7E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20Cl2N2
InChI InChI=1S/C22H20Cl2N2/c1-20(2)21(14-6-10-16(23)11-7-14)18-4-3-5-19(18)22(20,26-25-21)15-8-12-17(24)13-9-15/h3-4,6-13,18-19H,5H2,1-2H3/t18-,19+,21-,22+/m1/s1
InChIKey VAKKVZTZVIGLRB-KIZRIRGWSA-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 383.320 g/mol
Solvent CDCl3
Source File Reference UWCP6921