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2-(5-nitro-2-pyridinyl)acetonitrile
SpectraBase Compound ID FaXe47t7jvh
InChI InChI=1S/C7H5N3O2/c8-4-3-6-1-2-7(5-9-6)10(11)12/h1-2,5H,3H2
InChIKey PHCKNSBYAFTJKZ-UHFFFAOYSA-N
Mol Weight 163.14 g/mol
Molecular Formula C7H5N3O2
Exact Mass 163.038176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3e56wipbTQr
Name 2-(5-nitro-2-pyridinyl)acetonitrile
Alternate Name(s) 2-(5-nitro-2-pyridyl)acetonitrile 2-(5-nitropyridin-2-yl)acetonitrile 2-(5-nitropyridin-2-yl)ethanenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C7H5N3O2
InChI InChI=1S/C7H5N3O2/c8-4-3-6-1-2-7(5-9-6)10(11)12/h1-2,5H,3H2
InChIKey PHCKNSBYAFTJKZ-UHFFFAOYSA-N
Molecular Weight 163.136 g/mol
SMILES c1(ccc(cn1)N(=O)=O)CC#N
SPLASH splash10-02t9-0900000000-3c2d649d13f5b6fa637d
Source of Spectrum SO-0-315-4
Wiley ID 1540651