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5-Benzylidene)-4-oxo-2-[1,3,3-tris(methoxycarbonyl)-2-phenylpropylidene]-tetrahydrothiazole
SpectraBase Compound ID 4ZLC29w7S8D
InChI InChI=1S/C25H23NO7S/c1-31-23(28)19(22-26-21(27)17(34-22)14-15-10-6-4-7-11-15)18(16-12-8-5-9-13-16)20(24(29)32-2)25(30)33-3/h4-14,18,20H,1-3H3,(H,26,27)/b17-14+,22-19-
InChIKey ZGNLQXCTNMRNCJ-WZBLNXIKSA-N
Mol Weight 481.52 g/mol
Molecular Formula C25H23NO7S
Exact Mass 481.119523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DyqNZJ4F9ik
Name 5-Benzylidene)-4-oxo-2-[1,3,3-tris(methoxycarbonyl)-2-phenylpropylidene]-tetrahydrothiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23NO7S
InChI InChI=1S/C25H23NO7S/c1-31-23(28)19(22-26-21(27)17(34-22)14-15-10-6-4-7-11-15)18(16-12-8-5-9-13-16)20(24(29)32-2)25(30)33-3/h4-14,18,20H,1-3H3,(H,26,27)/b17-14+,22-19-
InChIKey ZGNLQXCTNMRNCJ-WZBLNXIKSA-N
Molecular Weight 481.519 g/mol
SMILES N1C(\C(S\C1=C/(C(C(C(=O)OC)C(=O)OC)c1ccccc1)C(=O)OC)=C/c1ccccc1)=O
SPLASH splash10-0udi-0209300000-76623b0cdd4ac113d71a
Source of Spectrum SO-1977-840-6
Wiley ID 1537062