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3-(phenethylamino)butyric acid methyl ester
SpectraBase Compound ID K3MIli0Qtsw
InChI InChI=1S/C13H19NO2/c1-11(10-13(15)16-2)14-9-8-12-6-4-3-5-7-12/h3-7,11,14H,8-10H2,1-2H3
InChIKey IAXUABQEBZQZRK-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4a9l5APlQjp
Name 3-(phenethylamino)butyric acid methyl ester
Alternate Name(s) 3-(2-phenylethylamino)butanoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-11(10-13(15)16-2)14-9-8-12-6-4-3-5-7-12/h3-7,11,14H,8-10H2,1-2H3
InChIKey IAXUABQEBZQZRK-UHFFFAOYSA-N
Molecular Weight 221.300 g/mol
SMILES N(C(CC(=O)OC)C)CCc1ccccc1
SPLASH splash10-001i-0900000000-5ce1a7b8c11c191eed47
Source of Spectrum KC-0-2046-1
Wiley ID 786416