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3-Amino-3-(2-bromo-phenyl)-propionic acid

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3-Amino-3-(2-bromo-phenyl)-propionic acid
SpectraBase Compound ID IYnmCQBTHrC
InChI InChI=1S/C9H10BrNO2/c10-7-4-2-1-3-6(7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)
InChIKey OETRFEPZCAGEMK-UHFFFAOYSA-N
Mol Weight 244.09 g/mol
Molecular Formula C9H10BrNO2
Exact Mass 242.989492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9JaCl3FEqQv
Name benzenepropanoic acid, beta-amino-2-bromo-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.989491564 u
Formula C9H10BrNO2
InChI InChI=1S/C9H10BrNO2/c10-7-4-2-1-3-6(7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)
InChIKey OETRFEPZCAGEMK-UHFFFAOYSA-N
Molecular Weight 244.088 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15682
Solvent DMSO-d6
Source Vendor ID: NMR/11210599; Lab Info: KLD; Lab Number: KLD-MGU0002