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Phenyl trichloromethanethiosulfonate
SpectraBase Compound ID LwvQg0hLDMV
InChI InChI=1S/C7H5Cl3O2S2/c8-7(9,10)14(11,12)13-6-4-2-1-3-5-6/h1-5H
InChIKey LVNFFZKQWZZYJB-UHFFFAOYSA-N
Mol Weight 291.59 g/mol
Molecular Formula C7H5Cl3O2S2
Exact Mass 289.879655 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kkCDEtHf54
Name Phenyl trichloromethanethiosulfonate
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5Cl3O2S2
InChI InChI=1S/C7H5Cl3O2S2/c8-7(9,10)14(11,12)13-6-4-2-1-3-5-6/h1-5H
InChIKey LVNFFZKQWZZYJB-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000657
Molecular Weight 291.594 g/mol
Reported Formula C7H5Cl3O2S2
SMILES C(S(Sc1ccccc1)(=O)=O)(Cl)(Cl)Cl
SPLASH splash10-0aou-0900000000-8d64da0c9e771cf9e472
Source of Spectrum ASC-362-SM4-1
Wiley ID 1855527