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5-Iodo-6-(p-toluenesulfonyl)hexen-1-ol

View entire compound with spectra: 1 MS (GC)

5-Iodo-6-(p-toluenesulfonyl)hexen-1-ol
SpectraBase Compound ID GCOtXFWH913
InChI InChI=1S/C13H19IO3S/c1-11-5-7-13(8-6-11)18(16,17)10-12(14)4-2-3-9-15/h5-8,12,15H,2-4,9-10H2,1H3
InChIKey SPZSMBAGMKXPLW-UHFFFAOYSA-N
Mol Weight 382.26 g/mol
Molecular Formula C13H19IO3S
Exact Mass 382.009961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ag4GnnR4wGp
Name 5-Iodo-6-(p-toluenesulfonyl)hexen-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19IO3S
InChI InChI=1S/C13H19IO3S/c1-11-5-7-13(8-6-11)18(16,17)10-12(14)4-2-3-9-15/h5-8,12,15H,2-4,9-10H2,1H3
InChIKey SPZSMBAGMKXPLW-UHFFFAOYSA-N
Molecular Weight 382.256 g/mol
SMILES OCCCCC(CS(c1ccc(cc1)C)(=O)=O)I
SPLASH splash10-0a4u-7920000000-1fa4f1a1d5c3dcf2b001
Source of Spectrum F-53-6174-7
Synonyms 5-iodo-6-[(4-methylphenyl)sulfonyl]-1-hexanol
Wiley ID 801940