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alpha-CHLORO-p-NITROTOLUENE
SpectraBase Compound ID AUjcSUyBF1D
InChI InChI=1S/C7H6ClNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2
InChIKey KGCNHWXDPDPSBV-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 37gYV9rEXSk
Name Benzene, 1-(chloromethyl)-4-nitro-
Alternate Name(s) .alpha.-Chloro-p-nitrotoluene 1-(chloromethyl)-4-nitro-benzene 4-(Chloromethyl)nitrobenzene 4-Nitrobenzyl chloride Benzyl chloride, 4-nitro- p-(Chloromethyl)nitrobenzene p-Nitrobenzyl chloride Toluene, .alpha.-chloro-p-nitro- CCRIS 2325 EINECS 202-822-7 HSDB 6323 NSC 9803
CAS Registry Number 100-14-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO2
InChI InChI=1S/C7H6ClNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2
InChIKey KGCNHWXDPDPSBV-UHFFFAOYSA-N
Molecular Weight 171.583 g/mol
SMILES c1(N(=O)=O)ccc(CCl)cc1
SPLASH splash10-000i-9800000000-af079baabc8c1e8cef54
Source of Spectrum W5-10945-0-0
Wiley ID 1167761