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3-Amino-3-(3,4-dichloro-phenyl)-propionic acid
SpectraBase Compound ID AS24mMYI7Xz
InChI InChI=1S/C9H9Cl2NO2/c10-6-2-1-5(3-7(6)11)8(12)4-9(13)14/h1-3,8H,4,12H2,(H,13,14)
InChIKey ACJWNKAQMZQVBW-UHFFFAOYSA-N
Mol Weight 234.08 g/mol
Molecular Formula C9H9Cl2NO2
Exact Mass 233.001034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WRYHWuHf4B
Name 3-Amino-3-(3,4-dichloro-phenyl)-propionic acid
Alternate Name(s) 3-Amino-3-(3,4-dichlorophenyl)propanoic acid 3-Azanyl-3-(3,4-dichlorophenyl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9Cl2NO2
InChI InChI=1S/C9H9Cl2NO2/c10-6-2-1-5(3-7(6)11)8(12)4-9(13)14/h1-3,8H,4,12H2,(H,13,14)
InChIKey ACJWNKAQMZQVBW-UHFFFAOYSA-N
Molecular Weight 234.082 g/mol
SMILES OC(CC(c1cc(Cl)c(cc1)Cl)N)=O
SPLASH splash10-00fr-7900000000-d59b719e2ad07ae2a52d
Wiley ID 1464804