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(Z)-8-[(R)-(p-Tolylsulfinyl)]-7-octenyl p-toleuenesulfonate
SpectraBase Compound ID 1hlunp3TUD2
InChI InChI=1S/C22H28O4S2/c1-19-9-13-21(14-10-19)27(23)18-8-6-4-3-5-7-17-26-28(24,25)22-15-11-20(2)12-16-22/h8-16,18H,3-7,17H2,1-2H3/b18-8-
InChIKey CFMWMKNJWWJASG-LSCVHKIXSA-N
Mol Weight 420.58 g/mol
Molecular Formula C22H28O4S2
Exact Mass 420.142902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wp1vD34y1N
Name (Z)-8-[(R)-(p-Tolylsulfinyl)]-7-octenyl p-toleuenesulfonate
Alternate Name(s) (Z)-8-[(R)-(p-Tolylsulfinyl)]-7-octenyl p-toluenesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C22H28O4S2
InChI InChI=1S/C22H28O4S2/c1-19-9-13-21(14-10-19)27(23)18-8-6-4-3-5-7-17-26-28(24,25)22-15-11-20(2)12-16-22/h8-16,18H,3-7,17H2,1-2H3/b18-8-
InChIKey CFMWMKNJWWJASG-LSCVHKIXSA-N
Molecular Weight 420.582 g/mol
SMILES c1(S(=O)(=O)OCCCCCC\C=C/[S@](c2ccc(cc2)C)=O)ccc(cc1)C
SPLASH splash10-006x-0900500000-ce24d4a9aedbd1c86358
Source of Spectrum F-56-7938-31
Wiley ID 858726