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(2S)-4-Benzyl-3-((2S,3R)-3-hydroxy-2-methylnonanoyl)thiazolidin-2-thione
SpectraBase Compound ID 717R5bEh85g
InChI InChI=1S/C20H29NO2S2/c1-3-4-5-9-12-18(22)15(2)19(23)21-17(14-25-20(21)24)13-16-10-7-6-8-11-16/h6-8,10-11,15,17-18,22H,3-5,9,12-14H2,1-2H3/t15-,17?,18+/m0/s1
InChIKey SNZINWPRDMROTG-DKKDMOBXSA-N
Mol Weight 379.58 g/mol
Molecular Formula C20H29NO2S2
Exact Mass 379.163972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3twQYduly9
Name (2S)-4-Benzyl-3-((2S,3R)-3-hydroxy-2-methylnonanoyl)thiazolidin-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO2S2
InChI InChI=1S/C20H29NO2S2/c1-3-4-5-9-12-18(22)15(2)19(23)21-17(14-25-20(21)24)13-16-10-7-6-8-11-16/h6-8,10-11,15,17-18,22H,3-5,9,12-14H2,1-2H3/t15-,17?,18+/m0/s1
InChIKey SNZINWPRDMROTG-DKKDMOBXSA-N
Molecular Weight 379.577 g/mol
SMILES O[C@@]([C@@](C(N1C(SCC1Cc1ccccc1)=S)=O)(C)[H])(CCCCCC)[H]
SPLASH splash10-001l-5962000000-52f307015163e27171d0
Source of Spectrum J-67-3807-6
Synonyms 4-Benzyl-3-[(2S,3R)-3-hydroxy-2-methylnonanoyl]-1,3-thiazolidine-2-thione
Wiley ID 1569986