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Ethyl 3-(4-(ethoxycarbonyl)phenyl)-5-methoxybenzo[b]thiophene-2-carboxylate
SpectraBase Compound ID IkE6w9S3sm5
InChI InChI=1S/C21H20O5S/c1-4-25-20(22)14-8-6-13(7-9-14)18-16-12-15(24-3)10-11-17(16)27-19(18)21(23)26-5-2/h6-12H,4-5H2,1-3H3
InChIKey ZYJGKNGNJOOSIN-UHFFFAOYSA-N
Mol Weight 384.45 g/mol
Molecular Formula C21H20O5S
Exact Mass 384.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DVa8sQ64UIK
Name Ethyl 3-(4-(ethoxycarbonyl)phenyl)-5-methoxybenzo[b]thiophene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O5S
InChI InChI=1S/C21H20O5S/c1-4-25-20(22)14-8-6-13(7-9-14)18-16-12-15(24-3)10-11-17(16)27-19(18)21(23)26-5-2/h6-12H,4-5H2,1-3H3
InChIKey ZYJGKNGNJOOSIN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201300049
Molecular Weight 384.446 g/mol
SMILES c1(ccc2sc(C(=O)OCC)c(-c3ccc(cc3)C(OCC)=O)c2c1)OC
SPLASH splash10-001r-0109000000-b982c3f6750ee9d38fa9
Source of Spectrum ASC-355-989/SM17-22
Wiley ID 1762009