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Ethyl 4-bromo-2-([(4-methylphenyl)sulfonyl]amino)butanoate
SpectraBase Compound ID 5jRc6KulP9e
InChI InChI=1S/C13H18BrNO4S/c1-3-19-13(16)12(8-9-14)15-20(17,18)11-6-4-10(2)5-7-11/h4-7,12,15H,3,8-9H2,1-2H3
InChIKey JOGQSPVXPAPJJW-UHFFFAOYSA-N
Mol Weight 364.25 g/mol
Molecular Formula C13H18BrNO4S
Exact Mass 363.013992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdhYw5WaY9k
Name BUTANOIC ACID, 4-BROMO-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-, ETHYL ESTER, (S)-
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Formula C13H18NO4SBr
InChI InChI=1S/C13H18BrNO4S/c1-3-19-13(16)12(8-9-14)15-20(17,18)11-6-4-10(2)5-7-11/h4-7,12,15H,3,8-9H2,1-2H3
InChIKey JOGQSPVXPAPJJW-UHFFFAOYSA-N
Molecular Weight 363.0135
SMILES N(C(C(OCC)=O)CCBr)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0006-9440000000-9902a52787d3b73f92f5
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany