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(E)-5-[(R)-(p-Tolylsulfinyl)]-4-pentenyl p-toluenesulfonate
SpectraBase Compound ID 7XGLp2VyR7N
InChI InChI=1S/C19H22O4S2/c1-16-6-10-18(11-7-16)24(20)15-5-3-4-14-23-25(21,22)19-12-8-17(2)9-13-19/h5-13,15H,3-4,14H2,1-2H3/b15-5+
InChIKey BYGLSCARFOIHRB-PJQLUOCWSA-N
Mol Weight 378.5 g/mol
Molecular Formula C19H22O4S2
Exact Mass 378.095952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfDYHpJogRF
Name (E)-5-[(R)-(p-Tolylsulfinyl)]-4-pentenyl p-toluenesulfonate
Alternate Name(s) (4E)-5-[(4-methylphenyl)sulfinyl]-4-pentenyl 4-methylbenzenesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C19H22O4S2
InChI InChI=1S/C19H22O4S2/c1-16-6-10-18(11-7-16)24(20)15-5-3-4-14-23-25(21,22)19-12-8-17(2)9-13-19/h5-13,15H,3-4,14H2,1-2H3/b15-5+
InChIKey BYGLSCARFOIHRB-PJQLUOCWSA-N
Molecular Weight 378.501 g/mol
SMILES c1(S(=O)(=O)OCCC\C=C\[S@](c2ccc(cc2)C)=O)ccc(cc1)C
SPLASH splash10-0a4i-0901000000-a26e8dcd9be0d308ae26
Source of Spectrum F-56-7933-7
Wiley ID 858747