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(E)-2-Hydroxy[(4-(benzenesulfonyl)-3-oxopentyl)methylidene]cyclohexane
SpectraBase Compound ID 65vlG7hgjWR
InChI InChI=1S/C18H24O4S/c1-14(23(21,22)16-10-3-2-4-11-16)17(19)13-7-9-15-8-5-6-12-18(15)20/h2-4,9-11,14,18,20H,5-8,12-13H2,1H3/b15-9+
InChIKey GJTIXBRQZZJNMI-OQLLNIDSSA-N
Mol Weight 336.45 g/mol
Molecular Formula C18H24O4S
Exact Mass 336.13953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TIrZ53HIhW
Name (E)-2-Hydroxy[(4-(benzenesulfonyl)-3-oxopentyl)methylidene]cyclohexane
Alternate Name(s) (6E)-6-(2-hydroxycyclohexylidene)-2-(phenylsulfonyl)-3-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O4S
InChI InChI=1S/C18H24O4S/c1-14(23(21,22)16-10-3-2-4-11-16)17(19)13-7-9-15-8-5-6-12-18(15)20/h2-4,9-11,14,18,20H,5-8,12-13H2,1H3/b15-9+
InChIKey GJTIXBRQZZJNMI-OQLLNIDSSA-N
Molecular Weight 336.446 g/mol
SMILES OC1\C(=C\CCC(C(S(=O)(=O)c2ccccc2)C)=O)CCCC1
SPLASH splash10-056r-6900000000-fac10ebaffc6b119440e
Source of Spectrum C-103-7557-0
Wiley ID 1332292