John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DpMnkkoYOLJ SpectraBase Spectrum ID=1KProLOTl5k

(accessed ).
(1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1,4-BIS-(4'-NITROPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
SpectraBase Compound ID DpMnkkoYOLJ
InChI InChI=1S/C22H20N4O4/c1-20(2)21(14-6-10-16(11-7-14)25(27)28)18-4-3-5-19(18)22(20,24-23-21)15-8-12-17(13-9-15)26(29)30/h3-4,6-13,18-19H,5H2,1-2H3/t18-,19+,21-,22+/m1/s1
InChIKey GAAKGSLEYBFWNF-KIZRIRGWSA-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 1KProLOTl5k
Name (1-ALPHA,4-ALPHA,4A-ALPHA,7A-ALPHA)-4,4A,7,7A-TETRAHYDRO-8,8-DIMETHYL-1,4-BIS-(4'-NITROPHENYL)-1,4-METHANO-1H-CYCLOPENTA-[D]-PYRIDAZINE
Compound Number 7H
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Formula C22H20N4O4
InChI InChI=1S/C22H20N4O4/c1-20(2)21(14-6-10-16(11-7-14)25(27)28)18-4-3-5-19(18)22(20,24-23-21)15-8-12-17(13-9-15)26(29)30/h3-4,6-13,18-19H,5H2,1-2H3/t18-,19+,21-,22+/m1/s1
InChIKey GAAKGSLEYBFWNF-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 404.425 g/mol
Solvent CDCl3
Source File Reference UWCP6924
SpectraBase Batch ID 5PgXYEmxA8A