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4-Phenyl-3-{[8-hydroxy-10,10-(propylidenedithioxo)pentadec-7-yl]carbonyl}thiazolidine-2-thione
SpectraBase Compound ID KF8VxHn0lhO
InChI InChI=1S/C28H43NO2S4/c1-3-5-7-11-16-23(25(30)20-28(17-12-6-4-2)34-18-13-19-35-28)26(31)29-24(21-33-27(29)32)22-14-9-8-10-15-22/h8-10,14-15,23-25,30H,3-7,11-13,16-21H2,1-2H3/t23-,24+,25+/m1/s1
InChIKey TXOPTNZJLNPVKJ-DSITVLBTSA-N
Mol Weight 553.9 g/mol
Molecular Formula C28H43NO2S4
Exact Mass 553.217664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9PgtH8pKKHy
Name 4-Phenyl-3-{[8-hydroxy-10,10-(propylidenedithioxo)pentadec-7-yl]carbonyl}thiazolidine-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H43NO2S4
InChI InChI=1S/C28H43NO2S4/c1-3-5-7-11-16-23(25(30)20-28(17-12-6-4-2)34-18-13-19-35-28)26(31)29-24(21-33-27(29)32)22-14-9-8-10-15-22/h8-10,14-15,23-25,30H,3-7,11-13,16-21H2,1-2H3/t23-,24+,25+/m1/s1
InChIKey TXOPTNZJLNPVKJ-DSITVLBTSA-N
Molecular Weight 553.897 g/mol
SMILES O[C@@](CC1(SCCCS1)CCCCC)([C@](C(N1C(SC[C@]1(c1ccccc1)[H])=S)=O)(CCCCCC)[H])[H]
SPLASH splash10-000i-0910000000-494534f4e98eb5b9b109
Source of Spectrum F-69-6144-17
Synonyms (2R)-2-[(1S)-1-hydroxy-2-(2-pentyl-1,3-dithian-2-yl)ethyl]-1-[(4R)-4-phenyl-2-sulfanylidene-3-thiazolidinyl]-1-octanone (2R)-2-[(1S)-1-hydroxy-2-(2-pentyl-1,3-dithian-2-yl)ethyl]-1-[(4R)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]octan-1-one (2R)-2-[(1S)-1-hydroxy-2-(2-pentyl-1,3-dithian-2-yl)ethyl]-1-[(4R)-4-phenyl-2-thioxo-thiazolidin-3-yl]octan-1-one (2R)-2-[(1S)-1-oxidanyl-2-(2-pentyl-1,3-dithian-2-yl)ethyl]-1-[(4R)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]octan-1-one
Wiley ID 1595585