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2-[(2S)-(2-Benzyl-3-oxo-3-[(4'S)-4'-(1-methylethyl)-2'-oxo-3-oxazolidinyl]propyl]1,3-dithiane
SpectraBase Compound ID G49M76uNbJW
InChI InChI=1S/C20H27NO3S2/c1-14(2)17-13-21(20(23)24-17)19(22)16(11-15-7-4-3-5-8-15)12-18-25-9-6-10-26-18/h3-5,7-8,14,16-18H,6,9-13H2,1-2H3/t16-,17+/m0/s1
InChIKey NZOZMTSAIFBJTJ-DLBZAZTESA-N
Mol Weight 393.56 g/mol
Molecular Formula C20H27NO3S2
Exact Mass 393.143236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1f7HuYzRAm
Name 2-[(2S)-(2-Benzyl-3-oxo-3-[(4'S)-4'-(1-methylethyl)-2'-oxo-3-oxazolidinyl]propyl]1,3-dithiane
Alternate Name(s) (5S)-3-[(2S)-2-benzyl-3-(1,3-dithian-2-yl)propanoyl]-5-isopropyl-1,3-oxazolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3S2
InChI InChI=1S/C20H27NO3S2/c1-14(2)17-13-21(20(23)24-17)19(22)16(11-15-7-4-3-5-8-15)12-18-25-9-6-10-26-18/h3-5,7-8,14,16-18H,6,9-13H2,1-2H3/t16-,17+/m0/s1
InChIKey NZOZMTSAIFBJTJ-DLBZAZTESA-N
Molecular Weight 393.560 g/mol
SMILES C1(N(C[C@@](O1)(C(C)C)[H])C([C@](CC1SCCCS1)(Cc1ccccc1)[H])=O)=O
SPLASH splash10-0gc0-3910000000-48cb0f5b4a32ee2cd6b5
Source of Spectrum J-58-2736-36
Wiley ID 1366235