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1H-isoindole-1,3(2H)-dione, 2-[4-(2-oxido-2-phenyldiazenyl)phenyl]-
SpectraBase Compound ID CBZYkWCOqSq
InChI InChI=1S/C20H13N3O3/c24-19-17-8-4-5-9-18(17)20(25)22(19)15-12-10-14(11-13-15)21-23(26)16-6-2-1-3-7-16/h1-13H/b23-21-
InChIKey FSJOTQFRKMLZFK-LNVKXUELSA-N
Mol Weight 343.34 g/mol
Molecular Formula C20H13N3O3
Exact Mass 343.095691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11H64fGUUIz
Name 1H-Isoindole-1,3(2H)-dione, 2-[4-(2-oxido-2-phenyldiazenyl)phenyl]-
Comments Computed using HOSE algorithm
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Exact Mass 343.095691288 u
Formula C20H13N3O3
InChI InChI=1S/C20H13N3O3/c24-19-17-8-4-5-9-18(17)20(25)22(19)15-12-10-14(11-13-15)21-23(26)16-6-2-1-3-7-16/h1-13H/b23-21-
InChIKey FSJOTQFRKMLZFK-LNVKXUELSA-N
Molecular Weight 343.342 g/mol
SMILES C1(=O)N(C(=O)C2=C1C=CC=C2)C1=CC=C(C=C1)N=N(=O)C1=CC=CC=C1