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N-(4-(4-bromophenyl)thiazol-2-yl)-3-oxobutanamide
SpectraBase Compound ID 4oLcEMcxEYF
InChI InChI=1S/C13H11BrN2O2S/c1-8(17)6-12(18)16-13-15-11(7-19-13)9-2-4-10(14)5-3-9/h2-5,7H,6H2,1H3,(H,15,16,18)
InChIKey JZGVAIGZIPACLI-UHFFFAOYSA-N
Mol Weight 339.21 g/mol
Molecular Formula C13H11BrN2O2S
Exact Mass 337.972462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HcGNq0K4l6
Name N-(4-(4-bromophenyl)thiazol-2-yl)-3-oxobutanamide
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Formula C13H11BrN2O2S
InChI InChI=1S/C13H11BrN2O2S/c1-8(17)6-12(18)16-13-15-11(7-19-13)9-2-4-10(14)5-3-9/h2-5,7H,6H2,1H3,(H,15,16,18)
InChIKey JZGVAIGZIPACLI-UHFFFAOYSA-N
Instrument Name AEI MS-30
Ionization Type EI
Literature Reference DOI 10.1002/aoc.5099
Molecular Weight 339.207 g/mol
SMILES N(c1nc(-c2ccc(Br)cc2)cs1)C(=O)CC(=O)C
SPLASH splash10-01xx-5920000000-b2dce451d40ca6d1bede
Source of Spectrum AOC-33-SM6-5e, H-BTOB
Wiley ID 1838328