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1,3,5-trimethyl-2-(methylthio)-1-cyclopent-3-enecarboxylic acid ethyl ester
SpectraBase Compound ID DAfiELOhAfS
InChI InChI=1S/C12H20O2S/c1-6-14-11(13)12(4)9(3)7-8(2)10(12)15-5/h7,9-10H,6H2,1-5H3
InChIKey BBPLNYHZFKIMSR-UHFFFAOYSA-N
Mol Weight 228.35 g/mol
Molecular Formula C12H20O2S
Exact Mass 228.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41GyfQp3RP9
Name 1,3,5-trimethyl-2-(methylthio)-1-cyclopent-3-enecarboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C12H20O2S
InChI InChI=1S/C12H20O2S/c1-6-14-11(13)12(4)9(3)7-8(2)10(12)15-5/h7,9-10H,6H2,1-5H3
InChIKey BBPLNYHZFKIMSR-UHFFFAOYSA-N
Molecular Weight 228.350 g/mol
SMILES C1(C(C=C(C1SC)C)C)(C(=O)OCC)C
SPLASH splash10-0a4i-0920000000-bbcdb2d7151c8d506046
Source of Spectrum J-61-4737-13
Synonyms 1,3,5-trimethyl-2-(methylthio)cyclopent-3-ene-1-carboxylic acid ethyl ester ethyl 1,3,5-trimethyl-2-methylsulfanyl-cyclopent-3-ene-1-carboxylate
Wiley ID 1229480