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5-Benzenesulfonyloxy-2-iodo-3-methoxyphenol
SpectraBase Compound ID 8L2sxlfyyNL
InChI InChI=1S/C13H11IO5S/c1-18-12-8-9(7-11(15)13(12)14)19-20(16,17)10-5-3-2-4-6-10/h2-8,15H,1H3
InChIKey JVIAYTTVDBLVNW-UHFFFAOYSA-N
Mol Weight 406.19 g/mol
Molecular Formula C13H11IO5S
Exact Mass 405.93719 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fkKhNdy8dX
Name 5-Benzenesulfonyloxy-2-iodo-3-methoxyphenol
CAS Registry Number 139220-55-6
Comments Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821109
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11IO5S
InChI InChI=1S/C13H11IO5S/c1-18-12-8-9(7-11(15)13(12)14)19-20(16,17)10-5-3-2-4-6-10/h2-8,15H,1H3
InChIKey JVIAYTTVDBLVNW-UHFFFAOYSA-N
Molecular Weight 406.190 g/mol
SMILES Oc1cc(OS(=O)(=O)c2ccccc2)cc(c1I)OC
SPLASH splash10-001r-9000000000-e62bd98af71e7e215788
Source of Spectrum K-125-1504-6
Synonyms 3-hydroxy-4-iodo-5-methoxyphenyl benzenesulfonate
Wiley ID 1371895