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Benzo[b]thiophene-3-carboxaldehyde

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

Benzo[b]thiophene-3-carboxaldehyde
SpectraBase Compound ID 2zxiasaM5EJ
InChI InChI=1S/C9H6O2S/c10-9(11)7-5-12-8-4-2-1-3-6(7)8/h1-5H,(H,10,11)
InChIKey DRBLTQNCQJXSNU-UHFFFAOYSA-N
Mol Weight 178.2 g/mol
Molecular Formula C9H6O2S
Exact Mass 178.008851 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E6MDv0AlMxx
Name BENZO[b]THIOPHENE-3-CARBOXYLIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6O2S
InChI InChI=1S/C9H6O2S/c10-9(11)7-5-12-8-4-2-1-3-6(7)8/h1-5H,(H,10,11)
InChIKey DRBLTQNCQJXSNU-UHFFFAOYSA-N
Melting Point 180C
Molecular Weight 178.21
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZO/B/THIOPHENE-3-CARBOXYLIC ACID