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2-Chloro-5-nitrobenzonitrile
SpectraBase Compound ID 3iUB6VKmbr4
InChI InChI=1S/C7H3ClN2O2/c8-7-2-1-6(10(11)12)3-5(7)4-9/h1-3H
InChIKey ZGILLTVEEBNDOB-UHFFFAOYSA-N
Mol Weight 182.57 g/mol
Molecular Formula C7H3ClN2O2
Exact Mass 181.988305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oQDDnaKh8q
Name Benzonitrile, 2-chloro-5-nitro-
CAS Registry Number 16588-02-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3ClN2O2
InChI InChI=1S/C7H3ClN2O2/c8-7-2-1-6(10(11)12)3-5(7)4-9/h1-3H
InChIKey ZGILLTVEEBNDOB-UHFFFAOYSA-N
Molecular Weight 182.566 g/mol
SMILES c1(Cl)ccc(cc1C#N)N(=O)=O
SPLASH splash10-0f8i-6900000000-90ceacbe14495ee13b48
Source of Spectrum JX-2012-938
Synonyms 2-Chloro-5-nitrobenzonitrile 2-Chlor-5-nitrobenzonitril 2-Chloranyl-5-nitro-benzenecarbonitrile 2-Chloro-5-nitro-benzonitrile 2-Chloro-5-nitrobenzenenitrile 5-Nitro-2-chlorobenzonitrile 6-Chloro-3-nitrobenzonitrile EINECS 240-643-6
Wiley ID 1661383