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3-Amino-3-(4-ethylphenyl)propanoic acid
SpectraBase Compound ID CeTuoZpooyq
InChI InChI=1S/C11H15NO2/c1-2-8-3-5-9(6-4-8)10(12)7-11(13)14/h3-6,10H,2,7,12H2,1H3,(H,13,14)
InChIKey CZOSHSPOVINZEF-UHFFFAOYSA-N
Mol Weight 193.25 g/mol
Molecular Formula C11H15NO2
Exact Mass 193.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BnnlvPR9AiJ
Name 3-Amino-3-(4-ethylphenyl)propanoic acid
CAS Registry Number 117391-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO2
InChI InChI=1S/C11H15NO2/c1-2-8-3-5-9(6-4-8)10(12)7-11(13)14/h3-6,10H,2,7,12H2,1H3,(H,13,14)
InChIKey CZOSHSPOVINZEF-UHFFFAOYSA-N
Molecular Weight 193.246 g/mol
SMILES OC(CC(c1ccc(cc1)CC)N)=O
SPLASH splash10-001i-6900000000-c4841a2af800277e87b0
Synonyms 3-Amino-3-(4-ethylphenyl)propionic acid 3-Azanyl-3-(4-ethylphenyl)propanoic acid Propanoic acid, 3-amino-3-(4-ethylphenyl)-
Wiley ID 1465299