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Acetic acid, 1-(7-benzo[B]thienyl)-ethyl ester

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Acetic acid, 1-(7-benzo[B]thienyl)-ethyl ester
SpectraBase Compound ID Al3ixivO6rQ
InChI InChI=1S/C12H12O2S/c1-8(14-9(2)13)11-5-3-4-10-6-7-15-12(10)11/h3-8H,1-2H3
InChIKey WFXDFLOKPUGGIY-UHFFFAOYSA-N
Mol Weight 220.29 g/mol
Molecular Formula C12H12O2S
Exact Mass 220.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DYJqCRlB8t8
Name Acetic acid, 1-(7-benzo[B]thienyl)-ethyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H12O2S
InChI InChI=1S/C12H12O2S/c1-8(14-9(2)13)11-5-3-4-10-6-7-15-12(10)11/h3-8H,1-2H3
InChIKey WFXDFLOKPUGGIY-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference S.S. Al-Showiman, I.M. Al-Najjar, Org. Magn. Resonance 20, 105 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3