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2-AMINO-3-THIOPHENECARBOXYLIC ACID, ETHYL ESTER
SpectraBase Compound ID tVhLebfUxT
InChI InChI=1S/C7H9NO2S/c1-2-10-7(9)5-3-4-11-6(5)8/h3-4H,2,8H2,1H3
InChIKey MKJQYFVTEPGXIE-UHFFFAOYSA-N
Mol Weight 171.21 g/mol
Molecular Formula C7H9NO2S
Exact Mass 171.0354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H8cdRgMuKzY
Name 2-AMINO-3-THIOPHENECARBOXYLIC ACID, ETHYL ESTER
Source of Sample A. M. Chippendale ICI Organic Division, Manchester (1975)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NO2S
InChI InChI=1S/C7H9NO2S/c1-2-10-7(9)5-3-4-11-6(5)8/h3-4H,2,8H2,1H3
InChIKey MKJQYFVTEPGXIE-UHFFFAOYSA-N
Molecular Weight 171.22
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WH-90
Synonyms 3-THIOPHENECARBOYXLIC ACID, 2-AMINO-, ETHYL ESTER