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4-(Dicyanomethyl)nitrobenzene
SpectraBase Compound ID 4FiIjZGSGJc
InChI InChI=1S/C9H5N3O2/c10-5-8(6-11)7-1-3-9(4-2-7)12(13)14/h1-4,8H
InChIKey HXEPLLFRQAVQQJ-UHFFFAOYSA-N
Mol Weight 187.16 g/mol
Molecular Formula C9H5N3O2
Exact Mass 187.038176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JX5HfhLk7Ds
Name 4-(Dicyanomethyl)nitrobenzene
Alternate Name(s) 2-(4-Nitrophenyl)malononitrile 2-(4-Nitrophenyl)propanedinitrile
CAS Registry Number 7077-65-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5N3O2
InChI InChI=1S/C9H5N3O2/c10-5-8(6-11)7-1-3-9(4-2-7)12(13)14/h1-4,8H
InChIKey HXEPLLFRQAVQQJ-UHFFFAOYSA-N
Molecular Weight 187.158 g/mol
SMILES c1(N(=O)=O)ccc(cc1)C(C#N)C#N
SPLASH splash10-01p6-5900000000-e714100a10bbd3249b0b
Wiley ID 1473749