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4-Chloro-2-nitro-toluene
SpectraBase Compound ID 2i1KAcQkvGK
InChI InChI=1S/C7H6ClNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3
InChIKey SQFLFRQWPBEDHM-UHFFFAOYSA-N
Mol Weight 171.58 g/mol
Molecular Formula C7H6ClNO2
Exact Mass 171.008706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3wCO9qZnwe
Name 4-Chloro-1-methyl-2-nitrobenzene
Alternate Name(s) 2-Nitro-4-chlorotoluene 4,2-Chloronitrotoluene 4-Chloranyl-1-methyl-2-nitro-benzene 4-Chloro-2-nitrotoluene Benzene, 4-chloro-1-methyl-2-nitro- Benzene, 4-chloro-1-methyl-3-nitro- p-Chloro-o-nitrotoluene Toluene, 4-chloro-2-nitro- AI3-00494 CCRIS 3116 EINECS 201-921-2 NSC 5386
CAS Registry Number 89-59-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO2
InChI InChI=1S/C7H6ClNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3
InChIKey SQFLFRQWPBEDHM-UHFFFAOYSA-N
Molecular Weight 171.583 g/mol
SMILES c1(N(=O)=O)c(C)ccc(c1)Cl
SPLASH splash10-0fbi-9700000000-a10d6e9d593d1f3395f2
Source of Spectrum PG-1982-1291-0
Wiley ID 1167756