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1-Benzothiophene-4,6-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 8CoDwtkRHP
InChI InChI=1S/C12H10O4S/c1-15-11(13)7-5-9(12(14)16-2)8-3-4-17-10(8)6-7/h3-6H,1-2H3
InChIKey UOMHNGFAHYCVJM-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 5zzY3zFpHbs
Name 1-Benzothiophene-4,6-dicarboxylic acid dimethyl ester
Alternate Name(s) benzothiophene-4,6-dicarboxylic acid dimethyl ester Dimethyl 1-benzothiophene-4,6-dicarboxylate Dimethyl benzothiophene-4,6-dicarboxylate
CAS Registry Number 123229-67-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O4S
InChI InChI=1S/C12H10O4S/c1-15-11(13)7-5-9(12(14)16-2)8-3-4-17-10(8)6-7/h3-6H,1-2H3
InChIKey UOMHNGFAHYCVJM-UHFFFAOYSA-N
Molecular Weight 250.268 g/mol
SMILES c1(c2c(scc2)cc(c1)C(=O)OC)C(=O)OC
SPLASH splash10-0uxr-0290000000-9fb085c21e2272a62e51
Source of Spectrum Y-26-399-6
Wiley ID 1252886