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(4R,5S)-3-[1-Oxo-3-(1,3-dithian-2-ylidene)-2-(2-cyclohexyl)propyl]-4-methyl-5-phenyl-2-oxazolidenone
SpectraBase Compound ID EqOHtjyj74u
InChI InChI=1S/C23H29NO3S2/c1-16-21(18-11-6-3-7-12-18)27-23(26)24(16)22(25)19(17-9-4-2-5-10-17)15-20-28-13-8-14-29-20/h3,6-7,11-12,15-17,19,21H,2,4-5,8-10,13-14H2,1H3/t16-,19?,21-/m1/s1
InChIKey GFSRQIBNCFOFET-SVAIFQIPSA-N
Mol Weight 431.61 g/mol
Molecular Formula C23H29NO3S2
Exact Mass 431.158886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQWEgUB5TPd
Name (4R,5S)-3-[1-Oxo-3-(1,3-dithian-2-ylidene)-2-(2-cyclohexyl)propyl]-4-methyl-5-phenyl-2-oxazolidenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO3S2
InChI InChI=1S/C23H29NO3S2/c1-16-21(18-11-6-3-7-12-18)27-23(26)24(16)22(25)19(17-9-4-2-5-10-17)15-20-28-13-8-14-29-20/h3,6-7,11-12,15-17,19,21H,2,4-5,8-10,13-14H2,1H3/t16-,19?,21-/m1/s1
InChIKey GFSRQIBNCFOFET-SVAIFQIPSA-N
Molecular Weight 431.609 g/mol
SMILES C1(N([C@@]([C@@](O1)(c1ccccc1)[H])(C)[H])C(C(C=C1SCCCS1)C1CCCCC1)=O)=O
SPLASH splash10-0kmj-9530000000-edea44c3633a0f43bed4
Source of Spectrum J-58-2733-23
Synonyms (4R,5S)-3-[2-cyclohexyl-3-(1,3-dithian-2-ylidene)propanoyl]-4-methyl-5-phenyl-1,3-oxazolidin-2-one
Wiley ID 1381962