Methyl 4-aminobutyrate

Methyl_4_aminobutyrate synonyms

Methyl 4-aminobutanoate; Methyl gamma-aminobutyrate; 4-Aminobutyric acid methyl ester; GABA methyl ester; Butanoic acid, 4-amino-, methyl ester (9CI); BUTYRIC ACID, 4-AMINO-, METHYL ESTER

Wikipedia:

Graphical representations:

methyl_4_aminobutyrate

View large 3D structure

Molecular Formula: C5H11NO2

Natural Isotopic Abundance Mass: 117.1463400000

Mono-Isotopic Molecular Masses:

  • C12N14: 117.078978603
  • C13N14: 122.095752792
  • C12N15: 118.076013496
  • C13N15: 123.0927876847

InChI string: InChI=1S/C5H11NO2/c1-8-5(7)3-2-4-6/h2-4,6H2,1H3

IUPAC: methyl 4-aminobutanoate

PubChem Compound (CID): 18614
CAS Registry number: 13031-60-2 3251-07-8
Beilstein Handbook Reference: 3-04-00-01316
PDB Compound ID: GVE

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)