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3-(1,3-benzothiazol-2-yl)propanoic acid
SpectraBase Compound ID DzoxPwxGFrQ
InChI InChI=1S/C10H9NO2S/c12-10(13)6-5-9-11-7-3-1-2-4-8(7)14-9/h1-4H,5-6H2,(H,12,13)
InChIKey WHNQTHDJEZTVHS-UHFFFAOYSA-N
Mol Weight 207.25 g/mol
Molecular Formula C10H9NO2S
Exact Mass 207.0354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID An7DQCXWSFH
Name 3-(1,3-benzothiazol-2-yl)propanoic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 207.035399706 u
Formula C10H9NO2S
InChI InChI=1S/C10H9NO2S/c12-10(13)6-5-9-11-7-3-1-2-4-8(7)14-9/h1-4H,5-6H2,(H,12,13)
InChIKey WHNQTHDJEZTVHS-UHFFFAOYSA-N
Molecular Weight 207.247 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1774
Solvent DMSO-d6
Source Vendor ID: NMR/12278383