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4-Nitro-5-[(1-phenylethyl)amino]phthalonitrile
SpectraBase Compound ID LMrzHZiPCyk
InChI InChI=1S/C16H12N4O2/c1-11(12-5-3-2-4-6-12)19-15-7-13(9-17)14(10-18)8-16(15)20(21)22/h2-8,11,19H,1H3
InChIKey SDPKTRZDDFHWNB-UHFFFAOYSA-N
Mol Weight 292.3 g/mol
Molecular Formula C16H12N4O2
Exact Mass 292.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9eVSlOHNdB
Name 4-Nitro-5-[(1-phenylethyl)amino]phthalonitrile
Alternate Name(s) 4-Nitro-5-[(1-phenylethyl)amino]benzene-1,2-dicarbonitrile 4-Nitro-5-(1-phenylethylamino)benzene-1,2-dicarbonitrile
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Formula C16H12N4O2
InChI InChI=1S/C16H12N4O2/c1-11(12-5-3-2-4-6-12)19-15-7-13(9-17)14(10-18)8-16(15)20(21)22/h2-8,11,19H,1H3
InChIKey SDPKTRZDDFHWNB-UHFFFAOYSA-N
Molecular Weight 292.298 g/mol
SMILES N(c1c(N(=O)=O)cc(c(C#N)c1)C#N)C(c1ccccc1)C
SPLASH splash10-0a4i-3940000000-46b64e390154a3c1109e
Source of Spectrum IY-3-101-0
Wiley ID 1718049