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4-Chloro-3,5-dinitrobenzonitrile
SpectraBase Compound ID LMsWsiJ1cjZ
InChI InChI=1S/C7H2ClN3O4/c8-7-5(10(12)13)1-4(3-9)2-6(7)11(14)15/h1-2H
InChIKey SCGDEDHSPCXGEC-UHFFFAOYSA-N
Mol Weight 227.56 g/mol
Molecular Formula C7H2ClN3O4
Exact Mass 226.973383 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6OxHA0mcFVd
Name Benzonitrile, 4-chloro-3,5-dinitro-
Alternate Name(s) 4-Chloranyl-3,5-dinitro-benzenecarbonitrile 4-Chloro-3,5-dinitro-benzonitrile 4-Chloro-3,5-dinitrobenzenenitrile AI3-28718 BRN 1990451 EINECS 217-686-4 NSC 74453
CAS Registry Number 1930-72-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H2ClN3O4
InChI InChI=1S/C7H2ClN3O4/c8-7-5(10(12)13)1-4(3-9)2-6(7)11(14)15/h1-2H
InChIKey SCGDEDHSPCXGEC-UHFFFAOYSA-N
Molecular Weight 227.563 g/mol
SMILES c1(N(=O)=O)c(Cl)c(N(=O)=O)cc(c1)C#N
SPLASH splash10-0fai-9420000000-21c5339554d83c03b971
Source of Spectrum W5-19311-0-0
Wiley ID 1228316