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2-Acetyl-6-amino-3-nitro-benzonitrile
SpectraBase Compound ID FvFQIxODCyH
InChI InChI=1S/C9H7N3O3/c1-5(13)9-6(4-10)7(11)2-3-8(9)12(14)15/h2-3H,11H2,1H3
InChIKey WNVKJVSKYOQAQI-UHFFFAOYSA-N
Mol Weight 205.17 g/mol
Molecular Formula C9H7N3O3
Exact Mass 205.048741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMnIGHaEH5Q
Name 2-Acetyl-6-amino-3-nitro-benzonitrile
Alternate Name(s) 6-Azanyl-2-ethanoyl-3-nitro-benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N3O3
InChI InChI=1S/C9H7N3O3/c1-5(13)9-6(4-10)7(11)2-3-8(9)12(14)15/h2-3H,11H2,1H3
InChIKey WNVKJVSKYOQAQI-UHFFFAOYSA-N
Molecular Weight 205.173 g/mol
SMILES Nc1ccc(c(c1C#N)C(=O)C)N(=O)=O
SPLASH splash10-0006-0930000000-451ddff2fa677533dcd9
Source of Spectrum AT-41-7096-4
Wiley ID 854906