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Benzene, [[[[(chloromethyl)sulfonyl]methyl]sulfonyl]methyl]-
SpectraBase Compound ID I9iT702kRPg
InChI InChI=1S/C9H11ClO4S2/c10-7-16(13,14)8-15(11,12)6-9-4-2-1-3-5-9/h1-5H,6-8H2
InChIKey PBUXWKNIXHKCIT-UHFFFAOYSA-N
Mol Weight 282.76 g/mol
Molecular Formula C9H11ClO4S2
Exact Mass 281.978729 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ucN1u3QBIg
Name Benzene, [[[[(chloromethyl)sulfonyl]methyl]sulfonyl]methyl]-
Alternate Name(s) [({[(Chloromethyl)sulfonyl]methyl}sulfonyl)methyl]benzene
CAS Registry Number 58751-72-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11ClO4S2
InChI InChI=1S/C9H11ClO4S2/c10-7-16(13,14)8-15(11,12)6-9-4-2-1-3-5-9/h1-5H,6-8H2
InChIKey PBUXWKNIXHKCIT-UHFFFAOYSA-N
Molecular Weight 282.756 g/mol
SMILES C(S(=O)(=O)CCl)S(=O)(=O)Cc1ccccc1
SPLASH splash10-0006-9100000000-d66c55beb7c875ad775b
Source of Spectrum W5-25343-0-0
Wiley ID 1285276