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(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-1,4-BIS-(3'-NITROPHENYL)-8,8-DIMETHYL-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE

View entire compound with spectra: 1 NMR

(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-1,4-BIS-(3'-NITROPHENYL)-8,8-DIMETHYL-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
SpectraBase Compound ID 9zPDqz2Cjb6
InChI InChI=1S/C22H20N4O4/c1-20(2)21(14-6-3-8-16(12-14)25(27)28)18-10-5-11-19(18)22(20,24-23-21)15-7-4-9-17(13-15)26(29)30/h3-10,12-13,18-19H,11H2,1-2H3/t18-,19+,21-,22+/m0/s1
InChIKey CPXUHCGPWHBWAF-YUVXSKOASA-N
Mol Weight 404.43 g/mol
Molecular Formula C22H20N4O4
Exact Mass 404.148455 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Azvu5Gyx4em
Name (1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-1,4-BIS-(3'-NITROPHENYL)-8,8-DIMETHYL-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
Compound Number 1,X=M-NO2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20N4O4
InChI InChI=1S/C22H20N4O4/c1-20(2)21(14-6-3-8-16(12-14)25(27)28)18-10-5-11-19(18)22(20,24-23-21)15-7-4-9-17(13-15)26(29)30/h3-10,12-13,18-19H,11H2,1-2H3/t18-,19+,21-,22+/m0/s1
InChIKey CPXUHCGPWHBWAF-YUVXSKOASA-N
Literature Reference Author W.M.NAU,H.M.HARRER,W.ADAM
Literature Reference Citation J.AM.CHEM.SOC.,116,10972(1994)
Literature Reference DOI 10.1021/ja00103a012
Molecular Weight 404.425 g/mol
Solvent CDCl3
Source File Reference UWSI318