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Benzo[b]thiophene-2-acetic acid, 3-formyl-, ethyl ester
SpectraBase Compound ID 6PK8Ha5ooqx
InChI InChI=1S/C13H12O3S/c1-2-16-13(15)7-12-10(8-14)9-5-3-4-6-11(9)17-12/h3-6,8H,2,7H2,1H3
InChIKey PWLHEIJKWWYLNO-UHFFFAOYSA-N
Mol Weight 248.3 g/mol
Molecular Formula C13H12O3S
Exact Mass 248.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkrI72BCo8n
Name Benzo[b]thiophene-2-acetic acid, 3-formyl-, ethyl ester
CAS Registry Number 128405-97-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O3S
InChI InChI=1S/C13H12O3S/c1-2-16-13(15)7-12-10(8-14)9-5-3-4-6-11(9)17-12/h3-6,8H,2,7H2,1H3
InChIKey PWLHEIJKWWYLNO-UHFFFAOYSA-N
Molecular Weight 248.296 g/mol
SMILES c1(c(c2ccccc2s1)C=O)CC(=O)OCC
SPLASH splash10-002b-0890000000-106603fe101a07a58484
Source of Spectrum KC-1990-686-17
Synonyms Ethyl (3-formyl-1-benzothien-2-yl)acetate Ethyl 3-formylbenzo[b]thiophen-2-ylacetate
Wiley ID 1250853