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4-Butoxy-3-(methylthio)-2-benzothiophene-1-carboxylic acid ethyl ester
SpectraBase Compound ID 97IxwlGc5EP
InChI InChI=1S/C16H20O3S2/c1-4-6-10-19-12-9-7-8-11-13(12)16(20-3)21-14(11)15(17)18-5-2/h7-9H,4-6,10H2,1-3H3
InChIKey KGKUCXWVHQMNOA-UHFFFAOYSA-N
Mol Weight 324.45 g/mol
Molecular Formula C16H20O3S2
Exact Mass 324.085387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28Pd0C2AEWK
Name 4-Butoxy-3-(methylthio)-2-benzothiophene-1-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O3S2
InChI InChI=1S/C16H20O3S2/c1-4-6-10-19-12-9-7-8-11-13(12)16(20-3)21-14(11)15(17)18-5-2/h7-9H,4-6,10H2,1-3H3
InChIKey KGKUCXWVHQMNOA-UHFFFAOYSA-N
Molecular Weight 324.453 g/mol
SMILES c1(c2c(c(s1)SC)c(ccc2)OCCCC)C(=O)OCC
SPLASH splash10-0gka-0595000000-1c7b3942c829bb814676
Source of Spectrum MZ-34-1460-2
Synonyms 4-Butoxy-3-(methylthio)isobenzothiophene-1-carboxylic acid ethyl ester
Wiley ID 1582206