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Malonic acid, 2-(2,3-dihydro-benzo[b]thiophen-5-yl)-2-hydroxy-, dimethyl ester
SpectraBase Compound ID niynUw7woK
InChI InChI=1S/C13H14O5S/c1-17-11(14)13(16,12(15)18-2)9-3-4-10-8(7-9)5-6-19-10/h3-4,7,16H,5-6H2,1-2H3
InChIKey GJCDEOVERGZLKU-UHFFFAOYSA-N
Mol Weight 282.31 g/mol
Molecular Formula C13H14O5S
Exact Mass 282.056195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0c8ct5kKjE
Name MALONIC ACID, 2-(2,3-DIHYDRO-BENZO[b]THIOPHEN-5-YL)-2-HYDROXY-, DIMETHYL ESTER
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Formula C13H14O5S
InChI InChI=1S/C13H14O5S/c1-17-11(14)13(16,12(15)18-2)9-3-4-10-8(7-9)5-6-19-10/h3-4,7,16H,5-6H2,1-2H3
InChIKey GJCDEOVERGZLKU-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 282.0558
SMILES OC(c1ccc2SCCc2c1)(C(OC)=O)C(=O)OC
SPLASH splash10-03di-2930000000-60f0f6bae59158d91fed
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany