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1-Benzothiophene-5,6-dicarboxylic acid dimethyl ester
SpectraBase Compound ID HEcBAC4ttEQ
InChI InChI=1S/C12H10O4S/c1-15-11(13)8-5-7-3-4-17-10(7)6-9(8)12(14)16-2/h3-6H,1-2H3
InChIKey HGEURZTWVZOSIY-UHFFFAOYSA-N
Mol Weight 250.27 g/mol
Molecular Formula C12H10O4S
Exact Mass 250.02998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgifJNT8hTe
Name 1-Benzothiophene-5,6-dicarboxylic acid dimethyl ester
CAS Registry Number 98449-83-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O4S
InChI InChI=1S/C12H10O4S/c1-15-11(13)8-5-7-3-4-17-10(7)6-9(8)12(14)16-2/h3-6H,1-2H3
InChIKey HGEURZTWVZOSIY-UHFFFAOYSA-N
Molecular Weight 250.268 g/mol
SMILES c1(c(cc2c(c1)ccs2)C(=O)OC)C(=O)OC
SPLASH splash10-014i-0090000000-7fb15945bc976ea7b32a
Source of Spectrum F-69-166-4a
Synonyms Benzothiophene-5,6-dicarboxylic acid dimethyl ester Dimethyl 1-benzothiophene-5,6-dicarboxylate Dimethyl benzo[b]thiophene-5,6-dicarboxylate Dimethyl benzothiophene-5,6-dicarboxylate
Wiley ID 1737319