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Ethyl (2S,3S)-2-(1,1-Dimethylethylsulfonamido)-3-isopropyl-5-[(S)-N-methylphenylsulfonimidoyl]pentanoate
SpectraBase Compound ID GOqF9vVt6Kn
InChI InChI=1S/C21H36N2O5S2/c1-8-28-20(24)19(23-30(26,27)21(4,5)6)18(16(2)3)14-15-29(25,22-7)17-12-10-9-11-13-17/h9-13,16,18-19,23H,8,14-15H2,1-7H3/t18-,19-,29-/m0/s1
InChIKey JVJAFOXQLRFGMD-GWZHAIQQSA-N
Mol Weight 460.6 g/mol
Molecular Formula C21H36N2O5S2
Exact Mass 460.206565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vzSW5Yoxk
Name Ethyl (2S,3S)-2-(1,1-Dimethylethylsulfonamido)-3-isopropyl-5-[(S)-N-methylphenylsulfonimidoyl]pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36N2O5S2
InChI InChI=1S/C21H36N2O5S2/c1-8-28-20(24)19(23-30(26,27)21(4,5)6)18(16(2)3)14-15-29(25,22-7)17-12-10-9-11-13-17/h9-13,16,18-19,23H,8,14-15H2,1-7H3/t18-,19-,29-/m0/s1
InChIKey JVJAFOXQLRFGMD-GWZHAIQQSA-N
Molecular Weight 460.648 g/mol
SMILES N(S(C(C)(C)C)(=O)=O)[C@](C(=O)OCC)([C@@](CC[S@](=NC)(=O)c1ccccc1)(C(C)C)[H])[H]
SPLASH splash10-0a4i-4901000000-2d6cd004d847fd78ccb1
Source of Spectrum U1-2011-6002-26
Synonyms (2S,3S)-2-(tert-butylsulfonylamino)-4-methyl-3-[2-(N-methyl-S-phenylsulfonimidoyl)ethyl]pentanoic acid ethyl ester Ethyl (2S,3S)-2-(tert-butylsulfonylamino)-4-methyl-3-[2-(N-methyl-S-phenylsulfonimidoyl)ethyl]pentanoate Ethyl (2S,3S)-2-(tert-butylsulfonylamino)-4-methyl-3-[2-(N-methyl-S-phenyl-sulfonimidoyl)ethyl]pentanoate
Wiley ID 1688777