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Ethyl 7-oxo-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 3mzGifgWWHL
InChI InChI=1S/C15H15NO3S/c1-2-19-15(18)12-10-6-5-7-11(17)13(10)20-14(12)16-8-3-4-9-16/h3-4,8-9H,2,5-7H2,1H3
InChIKey ATBIVZVSVDEFCL-UHFFFAOYSA-N
Mol Weight 289.35 g/mol
Molecular Formula C15H15NO3S
Exact Mass 289.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2mxZFvEsAy
Name Ethyl 7-oxo-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS Registry Number 328012-79-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO3S
InChI InChI=1S/C15H15NO3S/c1-2-19-15(18)12-10-6-5-7-11(17)13(10)20-14(12)16-8-3-4-9-16/h3-4,8-9H,2,5-7H2,1H3
InChIKey ATBIVZVSVDEFCL-UHFFFAOYSA-N
Molecular Weight 289.349 g/mol
SMILES c1(c(c2CCCC(c2s1)=O)C(=O)OCC)-[n]1cccc1
SPLASH splash10-000l-2390000000-1e91ac2718133d4da6e6
Source of Spectrum AD-0-2532-0
Synonyms 7-keto-2-pyrrol-1-yl-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester 7-Oxo-2-(1-pyrrolyl)-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester Benzo[b]thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-7-oxo-2-(1H-pyrrol-1-yl)-, ethyl ester Ethyl 7-oxidanylidene-2-pyrrol-1-yl-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Ethyl 7-oxo-2-pyrrol-1-yl-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Ethyl 7-oxo-2-pyrrol-1-yl-5,6-dihydro-4H-benzothiophene-3-carboxylate
Wiley ID 1426515