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4-Chloro-3-nitrotoluene
SpectraBase Compound ID FzWYJJK8ZcZ
InChI InChI=1S/C7H6ClNO2/c1-5-2-3-6(8)7(4-5)9(10)11/h2-4H,1H3
InChIKey NWESJZZPAJGHRZ-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 Kn3zDfKa0tB
Name Benzene, 1-chloro-4-methyl-2-nitro-
Alternate Name(s) 1-Chloranyl-4-methyl-2-nitro-benzene 1-Chloro-4-methyl-2-nitro-benzene 2-Chloro-5-methylnitrobenzene 3-Nitro-4-chlorotoluene 4,3-Chloronitrotoluene 4-Chloro-3-nitrotoluene Toluene, 4-chloro-3-nitro- EINECS 201-922-8 NSC 60721
CAS Registry Number 89-60-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO2
InChI InChI=1S/C7H6ClNO2/c1-5-2-3-6(8)7(4-5)9(10)11/h2-4H,1H3
InChIKey NWESJZZPAJGHRZ-UHFFFAOYSA-N
Molecular Weight 171.583 g/mol
SMILES c1(N(=O)=O)c(Cl)ccc(c1)C
SPLASH splash10-03mr-9400000000-1d00e077c51d44e06ec1
Source of Spectrum W6-11362-0-0
Wiley ID 86911