3-Amino-3-(4-hydroxyphenyl)propanoic acid

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Systematic / IUPAC Name: 3-Amino-3-(4-hydroxyphenyl)propanoic acid

ID: Reference190

Other Names: 3-Amino-3-(4-hydroxyphenyl)propionic acid;
Propanoic acid, 3-amino-3-(4-hydroxyphenyl)-

Formula: C9H11NO3

Class: Endogenous Metabolites

Spectral Data

3-Amino-3-(4-hydroxyphenyl)propanoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 124
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 11/18/2014 7:39:06 AM
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Identificators

InChI InChI=1S/C9H11NO3/c10-8(5-9(12)13)6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)
InChI Key JYPHNHPXFNEZBR-UHFFFAOYSA-N
Canonical SMILES C1=CC(=CC=C1C(CC(=O)O)N)O
CAS 6049543
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Other Names 3-Amino-3-(4-hydroxyphenyl)propionic acid;
Propanoic acid, 3-amino-3-(4-hydroxyphenyl)-

In Other Databases

KEGG C04368
ChEBI CHEBI:16939; CHEBI:57956
ChemSpider 389285
HMDb HMDB03831
PubChem 440311; 4357428