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(2S)-2-[butyl-(4-cyanophenyl)sulfonyl-amino]-3-methyl-butyric acid methyl ester
SpectraBase Compound ID 8rSjJAmcOgI
InChI InChI=1S/C17H24N2O4S/c1-5-6-11-19(16(13(2)3)17(20)23-4)24(21,22)15-9-7-14(12-18)8-10-15/h7-10,13,16H,5-6,11H2,1-4H3/t16-/m0/s1
InChIKey CNYIEMJAYXVJAK-INIZCTEOSA-N
Mol Weight 352.45 g/mol
Molecular Formula C17H24N2O4S
Exact Mass 352.145678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9djqnfcyG5
Name (2S)-2-[butyl-(4-cyanophenyl)sulfonyl-amino]-3-methyl-butyric acid methyl ester
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Formula C17H24N2O4S
InChI InChI=1S/C17H24N2O4S/c1-5-6-11-19(16(13(2)3)17(20)23-4)24(21,22)15-9-7-14(12-18)8-10-15/h7-10,13,16H,5-6,11H2,1-4H3/t16-/m0/s1
InChIKey CNYIEMJAYXVJAK-INIZCTEOSA-N
Molecular Weight 352.449 g/mol
SMILES [C@](N(S(c1ccc(C#N)cc1)(=O)=O)CCCC)(C(=O)OC)(C(C)C)[H]
SPLASH splash10-0006-6590000000-3f3a862e7c83255fa85f
Source of Spectrum F-54-15796-0
Synonyms (2S)-2-[butyl-(4-cyanophenyl)sulfonylamino]-3-methylbutanoic acid methyl ester Methyl (2S)-2-[butyl-(4-cyanophenyl)sulfonyl-amino]-3-methyl-butanoate
Wiley ID 804288