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(E)-2-methyl-4-(4-methylphenyl)sulfonyl-2-pentenoic acid methyl ester
SpectraBase Compound ID BBOsCBXVBEP
InChI InChI=1S/C14H18O4S/c1-10-5-7-13(8-6-10)19(16,17)12(3)9-11(2)14(15)18-4/h5-9,12H,1-4H3/b11-9+
InChIKey POEBRMDAFKLFKD-PKNBQFBNSA-N
Mol Weight 282.35 g/mol
Molecular Formula C14H18O4S
Exact Mass 282.09258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Ym2qMHLOuk
Name (E)-2-methyl-4-(4-methylphenyl)sulfonyl-2-pentenoic acid methyl ester
Alternate Name(s) (E)-2-methyl-4-tosyl-pent-2-enoic acid methyl ester Methyl (E)-2-methyl-4-(4-methylphenyl)sulfonyl-pent-2-enoate Methyl (E)-2-methyl-4-(p-tolylsulfonyl)pent-2-enoate
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Formula C14H18O4S
InChI InChI=1S/C14H18O4S/c1-10-5-7-13(8-6-10)19(16,17)12(3)9-11(2)14(15)18-4/h5-9,12H,1-4H3/b11-9+
InChIKey POEBRMDAFKLFKD-PKNBQFBNSA-N
Molecular Weight 282.354 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(\C=C\(C(=O)OC)C)C
SPLASH splash10-016v-9300000000-21e8d592dedf91878c17
Source of Spectrum F-52-15250-6
Wiley ID 799697