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3-(3,4-Dihydroxyphenyl)-D,L-alanine

View entire compound with spectra: 9 NMR, 4 FTIR, 2 Raman, and 16 MS (GC)

3-(3,4-Dihydroxyphenyl)-D,L-alanine
SpectraBase Compound ID 1pF3VYSpen1
InChI InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)
InChIKey WTDRDQBEARUVNC-UHFFFAOYSA-N
Mol Weight 197.19 g/mol
Molecular Formula C9H11NO4
Exact Mass 197.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FyOy2IVsw0
Name 2-AMINO-3-(3,4-DIHYDROXYPHENYL)PROPIONIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H11NO4
InChI InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)
InChIKey WTDRDQBEARUVNC-UHFFFAOYSA-N
Molecular Weight 197.0685
SMILES Oc1c(O)cc(cc1)CC(C(O)=O)N
SPLASH splash10-00di-5900000000-42057f5418aa40ad2552
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