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2-(aminomethyl)butanoic acid
SpectraBase Compound ID 56V6XN5NFUL
InChI InChI=1S/C5H11NO2/c1-2-4(3-6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
InChIKey HBICVCPHTYGKKD-UHFFFAOYSA-N
Mol Weight 117.15 g/mol
Molecular Formula C5H11NO2
Exact Mass 117.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FozZ9JaqfAx
Name 2-(aminomethyl)butanoic acid
CAS Registry Number 4385-92-6
Comments Less than 3 mono-isotopic peaks
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Formula C5H11NO2
InChI InChI=1S/C5H11NO2/c1-2-4(3-6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
InChIKey HBICVCPHTYGKKD-UHFFFAOYSA-N
Molecular Weight 117.148 g/mol
SMILES OC(C(CN)CC)=O
SPLASH splash10-014i-3900000000-5ebf55eb8f86489012de
Source of Spectrum B-41-1207-6
Synonyms 2-(aminomethyl)butyric acid
Wiley ID 1126095