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Benzene, 1-[(2-chloroethyl)sulfonyl]-4-nitro-
SpectraBase Compound ID DkHCuGBP5MS
InChI InChI=1S/C8H8ClNO4S/c9-5-6-15(13,14)8-3-1-7(2-4-8)10(11)12/h1-4H,5-6H2
InChIKey XJTIHTHZQXELBZ-UHFFFAOYSA-N
Mol Weight 249.67 g/mol
Molecular Formula C8H8ClNO4S
Exact Mass 248.986257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwlmEWdovy2
Name Benzene, 1-[(2-chloroethyl)sulfonyl]-4-nitro-
Alternate Name(s) 1-[(2-Chloroethyl)sulfonyl]-4-nitrobenzene 2-Chloroethyl 4-nitrophenyl sulfone p-Nitrophenyl 2-chloroethyl sulfone Sulfone, 2-chloroethyl p-nitrophenyl 1-(2-Chloroethylsulfonyl)-4-nitrobenzene AI3-16222 BRN 1885055
CAS Registry Number 6461-63-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8ClNO4S
InChI InChI=1S/C8H8ClNO4S/c9-5-6-15(13,14)8-3-1-7(2-4-8)10(11)12/h1-4H,5-6H2
InChIKey XJTIHTHZQXELBZ-UHFFFAOYSA-N
Molecular Weight 249.668 g/mol
SMILES C(Cl)CS(=O)(=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-03g0-9410000000-cc1c06b47baa77d37232
Source of Spectrum OS-6-57-0
Wiley ID 1251901