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(all E)-13-Demethylretinal - 2,4-dinitrophenylhydrazone
SpectraBase Compound ID 4oWnBccAH5d
InChI InChI=1S/C25H30N4O4/c1-19(12-14-22-20(2)11-9-16-25(22,3)4)10-7-5-6-8-17-26-27-23-15-13-21(28(30)31)18-24(23)29(32)33/h5-8,10,12-15,17-18,27H,9,11,16H2,1-4H3/b7-5+,8-6+,14-12+,19-10+,26-17+
InChIKey CGPGVMKXDUEMKL-RVZMJKKRSA-N
Mol Weight 450.54 g/mol
Molecular Formula C25H30N4O4
Exact Mass 450.226705 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ma4he016vT
Name (all E)-13-Demethylretinal - 2,4-dinitrophenylhydrazone
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Formula C25H30N4O4
InChI InChI=1S/C25H30N4O4/c1-19(12-14-22-20(2)11-9-16-25(22,3)4)10-7-5-6-8-17-26-27-23-15-13-21(28(30)31)18-24(23)29(32)33/h5-8,10,12-15,17-18,27H,9,11,16H2,1-4H3/b7-5+,8-6+,14-12+,19-10+,26-17+
InChIKey CGPGVMKXDUEMKL-RVZMJKKRSA-N
Molecular Weight 450.539 g/mol
SMILES N(\N=C\C=C\C=C\C=C\(\C=C\C1=C(CCCC1(C)C)C)C)c1c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-00mo-9530100000-e9e270952167afefe31e
Source of Spectrum AC-134-945-20
Synonyms (1E,2E,4E,6E,8E)-7-methyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenal (2,4-dinitrophenyl)hydrazone
Wiley ID 812575