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(E)-4-(2-Oxocyclopentyl)-1-butenyl Phenyl Sulfoxide Ethylene Ketal
SpectraBase Compound ID GigLmV5jCID
InChI InChI=1S/C17H22O3S/c18-21(16-9-2-1-3-10-16)14-5-4-7-15-8-6-11-17(15)19-12-13-20-17/h1-3,5,9-10,14-15H,4,6-8,11-13H2/b14-5+
InChIKey KEBAJAIWBAEFNK-LHHJGKSTSA-N
Mol Weight 306.42 g/mol
Molecular Formula C17H22O3S
Exact Mass 306.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bz73MwQxP7B
Name (E)-4-(2-Oxocyclopentyl)-1-butenyl Phenyl Sulfoxide Ethylene Ketal
Alternate Name(s) (1E)-4-(1,4-dioxaspiro[4.4]non-6-yl)-1-butenyl phenyl sulfoxide 4-[(E)-4-(benzenesulfinyl)but-3-enyl]-6,9-dioxaspiro[4.4]nonane 4-[(E)-4-(phenylsulfinyl)but-3-enyl]-6,9-dioxaspiro[4.4]nonane 6-[(3E)-4-(phenylsulfinyl)-3-butenyl]-1,4-dioxaspiro[4.4]nonane 9-[(E)-4-(phenylsulfinyl)but-3-enyl]-1,4-dioxaspiro[4.4]nonane
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Formula C17H22O3S
InChI InChI=1S/C17H22O3S/c18-21(16-9-2-1-3-10-16)14-5-4-7-15-8-6-11-17(15)19-12-13-20-17/h1-3,5,9-10,14-15H,4,6-8,11-13H2/b14-5+
InChIKey KEBAJAIWBAEFNK-LHHJGKSTSA-N
Molecular Weight 306.420 g/mol
SMILES C12(OCCO2)C(CCC1)CC\C=C\S(=O)c1ccccc1
SPLASH splash10-052e-9343000000-c592eb3d8095220f1f5f
Source of Spectrum J-59-1440-0
Wiley ID 1308049