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Ethyl 2-{[3-(4-bromophenyl)-3-oxopropanthioyl]amino}acetate
SpectraBase Compound ID BQP4t3IEKzn
InChI InChI=1S/C13H14BrNO3S/c1-2-18-13(17)8-15-12(19)7-11(16)9-3-5-10(14)6-4-9/h3-6H,2,7-8H2,1H3,(H,15,19)
InChIKey MDBPZUAXTCPHBB-UHFFFAOYSA-N
Mol Weight 344.22 g/mol
Molecular Formula C13H14BrNO3S
Exact Mass 342.987777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AuaZCclmXkX
Name Ethyl 2-{[3-(4-bromophenyl)-3-oxopropanthioyl]amino}acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BrNO3S
InChI InChI=1S/C13H14BrNO3S/c1-2-18-13(17)8-15-12(19)7-11(16)9-3-5-10(14)6-4-9/h3-6H,2,7-8H2,1H3,(H,15,19)
InChIKey MDBPZUAXTCPHBB-UHFFFAOYSA-N
Molecular Weight 344.223 g/mol
SMILES N(CC(=O)OCC)C(CC(=O)c1ccc(cc1)Br)=S
SPLASH splash10-053r-0905000000-9076e4eecee07b6d53f4
Source of Spectrum F-62-1712-3
Synonyms Ethyl {[3-(4-bromophenyl)-3-oxopropanethioyl]amino}acetate
Wiley ID 1632277