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2-[(2-(E)-2-Iodo-3-(phenylsulfonyl)-2-propenyl]cyclooctanone
SpectraBase Compound ID 6PvqoLwcwwH
InChI InChI=1S/C17H21IO3S/c18-15(12-14-8-4-1-2-7-11-17(14)19)13-22(20,21)16-9-5-3-6-10-16/h3,5-6,9-10,13-14H,1-2,4,7-8,11-12H2/b15-13+
InChIKey PRYPVPAAPOQVPA-FYWRMAATSA-N
Mol Weight 432.32 g/mol
Molecular Formula C17H21IO3S
Exact Mass 432.025611 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8okbGV1kRrZ
Name 2-[(2-(E)-2-Iodo-3-(phenylsulfonyl)-2-propenyl]cyclooctanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21IO3S
InChI InChI=1S/C17H21IO3S/c18-15(12-14-8-4-1-2-7-11-17(14)19)13-22(20,21)16-9-5-3-6-10-16/h3,5-6,9-10,13-14H,1-2,4,7-8,11-12H2/b15-13+
InChIKey PRYPVPAAPOQVPA-FYWRMAATSA-N
Molecular Weight 432.316 g/mol
SMILES C(\C(=C/S(=O)(=O)c1ccccc1)I)C1C(=O)CCCCCC1
SPLASH splash10-056u-9860000000-9488bd45bef19be49e1c
Source of Spectrum J-57-1176-27
Wiley ID 1382091