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Sulfone, p-nitrobenzyl trichloromethyl
SpectraBase Compound ID IljloObhdNy
InChI InChI=1S/C8H6Cl3NO4S/c9-8(10,11)17(15,16)5-6-1-3-7(4-2-6)12(13)14/h1-4H,5H2
InChIKey MIHZYBSIFQUIEI-UHFFFAOYSA-N
Mol Weight 318.56 g/mol
Molecular Formula C8H6Cl3NO4S
Exact Mass 316.908312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAIShV4L017
Name Sulfone, p-nitrobenzyl trichloromethyl
CAS Registry Number 15894-01-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6Cl3NO4S
InChI InChI=1S/C8H6Cl3NO4S/c9-8(10,11)17(15,16)5-6-1-3-7(4-2-6)12(13)14/h1-4H,5H2
InChIKey MIHZYBSIFQUIEI-UHFFFAOYSA-N
Molecular Weight 318.558 g/mol
SMILES C(S(Cc1ccc(N(=O)=O)cc1)(=O)=O)(Cl)(Cl)Cl
SPLASH splash10-000l-9200000000-ee6e3f19eab2ccc53f9b
Source of Spectrum EP-5645-0-0
Synonyms 4-Nitrobenzyl trichloromethyl sulfone 1-Nitro-4-{[(trichloromethyl)sulfonyl]methyl}benzene p-Nitro-b-sulfonicacidmethyltrichloride
Wiley ID 1317444