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2-((4-Methoxyphenyl)ethynyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
SpectraBase Compound ID 9Y1QkveS2y4
InChI InChI=1S/C18H17NO2S/c1-21-13-9-6-12(7-10-13)8-11-16-17(18(19)20)14-4-2-3-5-15(14)22-16/h6-7,9-10H,2-5H2,1H3,(H2,19,20)
InChIKey XOBBHOMTESKPNA-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C18H17NO2S
Exact Mass 311.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96Mko4wtyga
Name 2-((4-Methoxyphenyl)ethynyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO2S
InChI InChI=1S/C18H17NO2S/c1-21-13-9-6-12(7-10-13)8-11-16-17(18(19)20)14-4-2-3-5-15(14)22-16/h6-7,9-10H,2-5H2,1H3,(H2,19,20)
InChIKey XOBBHOMTESKPNA-UHFFFAOYSA-N
Molecular Weight 311.399 g/mol
SMILES NC(c1c(sc2c1CCCC2)C#Cc1ccc(cc1)OC)=O
SPLASH splash10-03di-0039000000-8128cc9e441b92a3f0ea
Source of Spectrum F-69-3180-8e
Wiley ID 1737945