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Methyl 3-(2,2-dibromovinyl)-4-[(3-thienylmethyl)amino]benzoate
SpectraBase Compound ID 7Sfvl48ctrE
InChI InChI=1S/C15H13Br2NO2S/c1-20-15(19)11-2-3-13(12(6-11)7-14(16)17)18-8-10-4-5-21-9-10/h2-7,9,18H,8H2,1H3
InChIKey HUJCGLDGZXODQS-UHFFFAOYSA-N
Mol Weight 431.14 g/mol
Molecular Formula C15H13Br2NO2S
Exact Mass 428.903376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6yXHQe4MrD5
Name Methyl 3-(2,2-dibromovinyl)-4-[(3-thienylmethyl)amino]benzoate
Alternate Name(s) Methyl 3-(2,2-dibromovinyl)-4-((thiophen-3-ylmethyl)amino)benzoate
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Formula C15H13Br2NO2S
InChI InChI=1S/C15H13Br2NO2S/c1-20-15(19)11-2-3-13(12(6-11)7-14(16)17)18-8-10-4-5-21-9-10/h2-7,9,18H,8H2,1H3
InChIKey HUJCGLDGZXODQS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol801932z
Molecular Weight 431.142 g/mol
SMILES N(Cc1ccsc1)c1c(cc(cc1)C(=O)OC)C=C(Br)Br
SPLASH splash10-0002-9010300000-acdd72446e48dd0d8396
Source of Spectrum A1-10-4633/SMS5-1e
Wiley ID 1759942