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N-Phenylsulfonyl-N-propargylleucine methyl ester
SpectraBase Compound ID BsLWYDfYy3U
InChI InChI=1S/C16H21NO4S/c1-5-11-17(15(12-13(2)3)16(18)21-4)22(19,20)14-9-7-6-8-10-14/h1,6-10,13,15H,11-12H2,2-4H3
InChIKey OITZYSWWPAFWQF-UHFFFAOYSA-N
Mol Weight 323.41 g/mol
Molecular Formula C16H21NO4S
Exact Mass 323.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 800P1jsP0xF
Name N-Phenylsulfonyl-N-propargylleucine methyl ester
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Formula C16H21NO4S
InChI InChI=1S/C16H21NO4S/c1-5-11-17(15(12-13(2)3)16(18)21-4)22(19,20)14-9-7-6-8-10-14/h1,6-10,13,15H,11-12H2,2-4H3
InChIKey OITZYSWWPAFWQF-UHFFFAOYSA-N
Molecular Weight 323.407 g/mol
SMILES C(N(S(=O)(=O)c1ccccc1)CC#C)(C(=O)OC)CC(C)C
SPLASH splash10-03yi-2590000000-c09e58d495ab12ac544e
Source of Spectrum KC-57-1365-2
Synonyms Methyl 4-methyl-2-[(phenylsulfonyl)(2-propynyl)amino]pentanoate 2-[benzenesulfonyl(prop-2-ynyl)amino]-4-methylpentanoic acid methyl ester Methyl 2-[benzenesulfonyl(prop-2-ynyl)amino]-4-methylpentanoate Methyl 2-[benzenesulfonyl(prop-2-ynyl)amino]-4-methyl-pentanoate Methyl 4-methyl-2-[phenylsulfonyl(prop-2-ynyl)amino]pentanoate
Wiley ID 1622914