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Ethyl Ester of (S)-2-[2-(4-Bromophenyl)-5-methyl-1H-pyrrol-1-yl]propionic Acid
SpectraBase Compound ID DQzJJvzvUNH
InChI InChI=1S/C16H18BrNO2/c1-4-20-16(19)12(3)18-11(2)5-10-15(18)13-6-8-14(17)9-7-13/h5-10,12H,4H2,1-3H3/t12-/m0/s1
InChIKey BSRWIQUCMFFHHN-LBPRGKRZSA-N
Mol Weight 336.23 g/mol
Molecular Formula C16H18BrNO2
Exact Mass 335.052092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JawuhWAHgRa
Name Ethyl Ester of (S)-2-[2-(4-Bromophenyl)-5-methyl-1H-pyrrol-1-yl]propionic Acid
Alternate Name(s) Ethyl Ester of 2-[2-(4-Bromophenyl)-5-methyl-1H-pyrrol-1-yl]propionic Acid (S)-ethyl 2-(2-(4-bromophenyl)-5-methyl-1H-pyrrol-1-yl)propanoate (2S)-2-[2-(4-bromophenyl)-5-methyl-1-pyrrolyl]propanoic acid ethyl ester Ethyl (2S)-2-[2-(4-bromophenyl)-5-methylpyrrol-1-yl]propanoate Ethyl (2S)-2-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]propanoate
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Formula C16H18BrNO2
InChI InChI=1S/C16H18BrNO2/c1-4-20-16(19)12(3)18-11(2)5-10-15(18)13-6-8-14(17)9-7-13/h5-10,12H,4H2,1-3H3/t12-/m0/s1
InChIKey BSRWIQUCMFFHHN-LBPRGKRZSA-N
Molecular Weight 336.229 g/mol
SMILES c1([n](c(cc1)C)[C@](C(=O)OCC)(C)[H])-c1ccc(cc1)Br
SPLASH splash10-03di-6493000000-52a3e22db7dd1f7b25f2
Source of Spectrum HC-47-192-4f
Wiley ID 1734048