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8-Iodo-1-phenyl-3-(phenylsulfonyl)octa-1,2-diene
SpectraBase Compound ID IqLkqPle7Ha
InChI InChI=1S/C20H21IO2S/c21-17-9-3-8-14-20(16-15-18-10-4-1-5-11-18)24(22,23)19-12-6-2-7-13-19/h1-2,4-7,10-13,15H,3,8-9,14,17H2
InChIKey HCMKDRSMKLKWMF-UHFFFAOYSA-N
Mol Weight 452.35 g/mol
Molecular Formula C20H21IO2S
Exact Mass 452.030696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9x6woYrywho
Name 8-Iodo-1-phenyl-3-(phenylsulfonyl)octa-1,2-diene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21IO2S
InChI InChI=1S/C20H21IO2S/c21-17-9-3-8-14-20(16-15-18-10-4-1-5-11-18)24(22,23)19-12-6-2-7-13-19/h1-2,4-7,10-13,15H,3,8-9,14,17H2
InChIKey HCMKDRSMKLKWMF-UHFFFAOYSA-N
Molecular Weight 452.350 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(=C=Cc1ccccc1)CCCCCI
SPLASH splash10-0udi-0000900000-90e76e35c5790c5d0923
Source of Spectrum F-66-3692-9dPh
Wiley ID 1685456