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3-Amino-3-(2,4-difluoro-phenyl)-propionic acid
SpectraBase Compound ID ApQVjTODtZ8
InChI InChI=1S/C9H9F2NO2/c10-5-1-2-6(7(11)3-5)8(12)4-9(13)14/h1-3,8H,4,12H2,(H,13,14)
InChIKey RXNSEGYWKJUNMR-UHFFFAOYSA-N
Mol Weight 201.17 g/mol
Molecular Formula C9H9F2NO2
Exact Mass 201.060135 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 15QqhhoeO81
Name benzenepropanoic acid, beta-amino-2,4-difluoro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 201.060134858 u
Formula C9H9F2NO2
InChI InChI=1S/C9H9F2NO2/c10-5-1-2-6(7(11)3-5)8(12)4-9(13)14/h1-3,8H,4,12H2,(H,13,14)
InChIKey RXNSEGYWKJUNMR-UHFFFAOYSA-N
Molecular Weight 201.173 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15691
Solvent DMSO-d6
Source Vendor ID: NMR/11210613; Lab Info: KLD; Lab Number: KLD-MGU0015