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(2S)-2-amino-3-(3-hydroxy-4-methoxyphenyl)propanoic acid hydrochloride
SpectraBase Compound ID 4rO2jRMF0sd
InChI InChI=1S/C10H13NO4.Cl/c1-15-9-3-2-6(5-8(9)12)4-7(11)10(13)14;/h2-3,5,7,12H,4,11H2,1H3,(H,13,14);/t7-;/m0./s1
InChIKey PTYSPZOIFAHVIJ-FJXQXJEOSA-N
Mol Weight 246.67 g/mol
Molecular Formula C10H13ClNO4
Exact Mass 246.053311 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JptTrEt9t8F
Name (2S)-2-amino-3-(3-hydroxy-4-methoxyphenyl)propanoic acid hydrochloride
CAS Registry Number 35296-56-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14ClNO4
InChI InChI=1S/C10H13NO4.Cl/c1-15-9-3-2-6(5-8(9)12)4-7(11)10(13)14;/h2-3,5,7,12H,4,11H2,1H3,(H,13,14);/t7-;/m0./s1
InChIKey PTYSPZOIFAHVIJ-FJXQXJEOSA-N
Molecular Weight 247.678 g/mol
SMILES Cl.Oc1cc(C[C@@](C(=O)O)(N)[H])ccc1OC
SPLASH splash10-000i-9600000000-962fd7765cbd5372d581
Source of Spectrum W6-1989-38268-27268
Synonyms 3-(3-Hydroxy-4-methoxyphenyl)-L-alanine hydrochloride
Wiley ID 138623