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3-[2-cyanoethyl-(4-methoxyphenyl)amino]propanoic acid
SpectraBase Compound ID 24Xvtrx9qgz
InChI InChI=1S/C13H16N2O3/c1-18-12-5-3-11(4-6-12)15(9-2-8-14)10-7-13(16)17/h3-6H,2,7,9-10H2,1H3,(H,16,17)
InChIKey HWOGXXNRYAUSAH-UHFFFAOYSA-N
Mol Weight 248.28 g/mol
Molecular Formula C13H16N2O3
Exact Mass 248.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXlVCVfv2pl
Name 3-[2-cyanoethyl-(4-methoxyphenyl)amino]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O3
InChI InChI=1S/C13H16N2O3/c1-18-12-5-3-11(4-6-12)15(9-2-8-14)10-7-13(16)17/h3-6H,2,7,9-10H2,1H3,(H,16,17)
InChIKey HWOGXXNRYAUSAH-UHFFFAOYSA-N
Molecular Weight 248.282 g/mol
SMILES OC(CCN(CCC#N)c1ccc(cc1)OC)=O
SPLASH splash10-052r-0950000000-319e97b86ac4084c97cd
Source of Spectrum KC-0-3203-5
Synonyms 3-[N-(2-cyanoethyl)-4-methoxy-anilino]propanoic acid 3-[N-(2-cyanoethyl)-4-methoxy-anilino]propionic acid
Wiley ID 823835