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3-(4-bromoanilino)butanoic acid ethyl ester
SpectraBase Compound ID D87kSiSf40d
InChI InChI=1S/C12H16BrNO2/c1-3-16-12(15)8-9(2)14-11-6-4-10(13)5-7-11/h4-7,9,14H,3,8H2,1-2H3
InChIKey IOZZMRSIQOVIRA-UHFFFAOYSA-N
Mol Weight 286.17 g/mol
Molecular Formula C12H16BrNO2
Exact Mass 285.036442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8WNmW6EyfTt
Name 3-(4-bromoanilino)butanoic acid ethyl ester
Alternate Name(s) 3-(4-bromoanilino)butyric acid ethyl ester Ethyl 3-(4-bromoanilino)butanoate Ethyl 3-[(4-bromophenyl)amino]butanoate
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Formula C12H16BrNO2
InChI InChI=1S/C12H16BrNO2/c1-3-16-12(15)8-9(2)14-11-6-4-10(13)5-7-11/h4-7,9,14H,3,8H2,1-2H3
InChIKey IOZZMRSIQOVIRA-UHFFFAOYSA-N
Molecular Weight 286.169 g/mol
SMILES N(C(CC(=O)OCC)C)c1ccc(cc1)Br
SPLASH splash10-0f6t-0590000000-8e4d88d5391f52e1a481
Source of Spectrum J-59-5333-3
Wiley ID 1288743