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2-(4-Chloro-phenylsulfanyl)-5-methyl-4-methylene-hex-5-enoic acid methyl ester
SpectraBase Compound ID DCWASI9jgUU
InChI InChI=1S/C15H17ClO2S/c1-10(2)11(3)9-14(15(17)18-4)19-13-7-5-12(16)6-8-13/h5-8,14H,1,3,9H2,2,4H3
InChIKey YLBQUTPZZRZORZ-UHFFFAOYSA-N
Mol Weight 296.81 g/mol
Molecular Formula C15H17ClO2S
Exact Mass 296.063779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BwbXgvboEH
Name 2-(4-Chloro-phenylsulfanyl)-5-methyl-4-methylene-hex-5-enoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C15H17ClO2S
InChI InChI=1S/C15H17ClO2S/c1-10(2)11(3)9-14(15(17)18-4)19-13-7-5-12(16)6-8-13/h5-8,14H,1,3,9H2,2,4H3
InChIKey YLBQUTPZZRZORZ-UHFFFAOYSA-N
Molecular Weight 296.812 g/mol
SMILES C(CC(C(=O)OC)Sc1ccc(cc1)Cl)(C(=C)C)=C
SPLASH splash10-0006-9020000000-1ee885376d399ec610b3
Source of Spectrum KC-20-841-2
Synonyms methyl 2-[(4-chlorophenyl)sulfanyl]-5-methyl-4-methylene-5-hexenoate
Wiley ID 787776