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4-[(2-Nitro-phenyl)-hydrazonomethyl]-benzonitrile
SpectraBase Compound ID 3S7RD5K1hDD
InChI InChI=1S/C14H10N4O2/c15-9-11-5-7-12(8-6-11)10-16-17-13-3-1-2-4-14(13)18(19)20/h1-8,10,17H/b16-10+
InChIKey KFEBRBRFEHQRRD-MHWRWJLKSA-N
Mol Weight 266.26 g/mol
Molecular Formula C14H10N4O2
Exact Mass 266.080376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EjagyiJYrZ1
Name 4-[(2-Nitro-phenyl)-hydrazonomethyl]-benzonitrile
Comments Computed using HOSE algorithm
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Exact Mass 266.080375576 u
Formula C14H10N4O2
InChI InChI=1S/C14H10N4O2/c15-9-11-5-7-12(8-6-11)10-16-17-13-3-1-2-4-14(13)18(19)20/h1-8,10,17H/b16-10+
InChIKey KFEBRBRFEHQRRD-MHWRWJLKSA-N
Molecular Weight 266.260 g/mol
SMILES C=1(C(=CC=CC1)N(=O)=O)N\N=C\C=1C=CC(C#N)=CC1