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3-(2,5-dichloro-3-thienyl)-3-keto-propionic acid methyl ester
SpectraBase Compound ID 28tE8Pxo76r
InChI InChI=1S/C8H6Cl2O3S/c1-13-7(12)3-5(11)4-2-6(9)14-8(4)10/h2H,3H2,1H3
InChIKey CMUQFIXDNLTOPB-UHFFFAOYSA-N
Mol Weight 253.1 g/mol
Molecular Formula C8H6Cl2O3S
Exact Mass 251.941471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GC79Sv1Yz4D
Name
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Formula C8H6Cl2O3S
InChI InChI=1S/C8H6Cl2O3S/c1-13-7(12)3-5(11)4-2-6(9)14-8(4)10/h2H,3H2,1H3
InChIKey CMUQFIXDNLTOPB-UHFFFAOYSA-N
Molecular Weight 251.9414
SMILES c1(sc(cc1C(CC(OC)=O)=O)Cl)Cl
SPLASH splash10-00pi-5930000000-3d9fed49d533344ed3da
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