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2-Phenoxymethyl-4-thiophen-carboxylic-acid
SpectraBase Compound ID 7NvwEev6DWl
InChI InChI=1S/C12H10O3S/c13-12(14)9-6-11(16-8-9)7-15-10-4-2-1-3-5-10/h1-6,8H,7H2,(H,13,14)
InChIKey NJTMBWWSHIOIOP-UHFFFAOYSA-N
Mol Weight 234.27 g/mol
Molecular Formula C12H10O3S
Exact Mass 234.035065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JpGzMJgOD46
Name 2-Phenoxymethyl-4-thiophen-carboxylic-acid
CAS Registry Number 61854-99-7
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H10O3S
InChI InChI=1S/C12H10O3S/c13-12(14)9-6-11(16-8-9)7-15-10-4-2-1-3-5-10/h1-6,8H,7H2,(H,13,14)
InChIKey NJTMBWWSHIOIOP-UHFFFAOYSA-N
Instrument Name SF = 060 MHz
Literature Reference J. Org. Chem. 45, 1366 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6