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3-(Bicyclo[4.4.1]undeca-1',3',5',7',9'-pentaen-2'-yl)propenal - 2',4'-dinotrophenylhydrazone
SpectraBase Compound ID AcHbuDlx4BT
InChI InChI=1S/C20H16N4O4/c25-23(26)18-10-11-19(20(14-18)24(27)28)22-21-12-4-9-16-8-3-6-15-5-1-2-7-17(16)13-15/h1-12,14,22H,13H2/b9-4+,21-12+
InChIKey TWRPXVRNQXRYHR-TXTYTQQBSA-N
Mol Weight 376.37 g/mol
Molecular Formula C20H16N4O4
Exact Mass 376.117155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZI9BXxMGD
Name 3-(Bicyclo[4.4.1]undeca-1',3',5',7',9'-pentaen-2'-yl)propenal - 2',4'-dinotrophenylhydrazone
Comments Less than 3 mono-isotopic peaks
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Formula C20H16N4O4
InChI InChI=1S/C20H16N4O4/c25-23(26)18-10-11-19(20(14-18)24(27)28)22-21-12-4-9-16-8-3-6-15-5-1-2-7-17(16)13-15/h1-12,14,22H,13H2/b9-4+,21-12+
InChIKey TWRPXVRNQXRYHR-TXTYTQQBSA-N
Molecular Weight 376.372 g/mol
SMILES N(\N=C\C=C\C1=C2CC(C=CC=C2)=CC=C1)c1c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-03di-9002000000-4051475ae863f13af661
Source of Spectrum G-56-2265-4
Wiley ID 748442