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3-(methylthio)-4-propan-2-yloxy-2-benzothiophene-1-carboxylic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

3-(methylthio)-4-propan-2-yloxy-2-benzothiophene-1-carboxylic acid ethyl ester
SpectraBase Compound ID HfS3LZQeGpT
InChI InChI=1S/C15H18O3S2/c1-5-17-14(16)13-10-7-6-8-11(18-9(2)3)12(10)15(19-4)20-13/h6-9H,5H2,1-4H3
InChIKey LUDAFKCOFTWNDC-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C15H18O3S2
Exact Mass 310.069737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AizKoCOJqzN
Name 3-(methylthio)-4-propan-2-yloxy-2-benzothiophene-1-carboxylic acid ethyl ester
Alternate Name(s) 4-isopropoxy-3-(methylthio)isobenzothiophene-1-carboxylic acid ethyl ester Ethyl 3-methylsulfanyl-4-propan-2-yloxy-2-benzothiophene-1-carboxylate
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Formula C15H18O3S2
InChI InChI=1S/C15H18O3S2/c1-5-17-14(16)13-10-7-6-8-11(18-9(2)3)12(10)15(19-4)20-13/h6-9H,5H2,1-4H3
InChIKey LUDAFKCOFTWNDC-UHFFFAOYSA-N
Molecular Weight 310.426 g/mol
SMILES c1(c2c(c(s1)SC)c(ccc2)OC(C)C)C(=O)OCC
SPLASH splash10-0wos-0983000000-5df9f87edb2cbd416090
Source of Spectrum MZ-34-1460-2
Wiley ID 1582208