| SpectraBase Compound ID | KfUiJUw3p1Q |
|---|---|
| InChI | InChI=1S/C14H13NO4S/c1-19-14(18)12-8-4-2-3-5-9(8)20-13(12)15-10(16)6-7-11(15)17/h6-7H,2-5H2,1H3 |
| InChIKey | QZGUIXUSLQTKAZ-UHFFFAOYSA-N |
| Mol Weight | 291.32 g/mol |
| Molecular Formula | C14H13NO4S |
| Exact Mass | 291.056529 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | WESSXGATE3 |
|---|---|
| Name | Methyl 2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| CAS Registry Number | 314279-09-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H13NO4S |
| InChI | InChI=1S/C14H13NO4S/c1-19-14(18)12-8-4-2-3-5-9(8)20-13(12)15-10(16)6-7-11(15)17/h6-7H,2-5H2,1H3 |
| InChIKey | QZGUIXUSLQTKAZ-UHFFFAOYSA-N |
| Molecular Weight | 291.321 g/mol |
| SMILES | c1(N2C(C=CC2=O)=O)c(c2CCCCc2s1)C(=O)OC |
| SPLASH | splash10-0zgl-6390000000-319ea36cb7eeb5e95e23 |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | 2-(2,5-dioxo-1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester 2-maleimido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-(2,5-dioxo-3-pyrrolin-1-yl)-, methyl ester Methyl 2-(2,5-dioxopyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Methyl 2-(2,5-dioxopyrrol-1-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Methyl 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Wiley ID | 1434977 |