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2-(benzylamino)benzoic acid ethyl ester
SpectraBase Compound ID 3OEV6utvvV9
InChI InChI=1S/C16H17NO2/c1-2-19-16(18)14-10-6-7-11-15(14)17-12-13-8-4-3-5-9-13/h3-11,17H,2,12H2,1H3
InChIKey NDBXPJMEGIQDJU-UHFFFAOYSA-N
Mol Weight 255.32 g/mol
Molecular Formula C16H17NO2
Exact Mass 255.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZKsVsMOfhB
Name 2-(benzylamino)benzoic acid ethyl ester
Alternate Name(s) 2-[(phenylmethyl)amino]benzoic acid ethyl ester ethyl 2-(benzylamino)benzoate ethyl 2-[(phenylmethyl)amino]benzoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO2
InChI InChI=1S/C16H17NO2/c1-2-19-16(18)14-10-6-7-11-15(14)17-12-13-8-4-3-5-9-13/h3-11,17H,2,12H2,1H3
InChIKey NDBXPJMEGIQDJU-UHFFFAOYSA-N
Molecular Weight 255.317 g/mol
SMILES N(c1c(C(=O)OCC)cccc1)Cc1ccccc1
SPLASH splash10-0a4i-0090000000-5e03fe5effdc1b756a81
Source of Spectrum E1-39-1156-5
Wiley ID 1518899