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N-(2,4-dimethylphenyl)-2-{(2E)-2-[(E)-methylimino]-4-oxo-1,3-thiazolidin-5-yl}acetamide
SpectraBase Compound ID 7lvhO8vToUx
InChI InChI=1S/C14H17N3O2S/c1-8-4-5-10(9(2)6-8)16-12(18)7-11-13(19)17-14(15-3)20-11/h4-6,11H,7H2,1-3H3,(H,16,18)(H,15,17,19)
InChIKey VIMVYNISHQAXDX-UHFFFAOYSA-N
Mol Weight 291.37 g/mol
Molecular Formula C14H17N3O2S
Exact Mass 291.104148 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HxRC6BwVdOw
Name N-(2,4-Dimethylphenyl)-2-{(2E)-2-[(E)-methylimino]-4-oxo-1,3-thiazolidin-5-yl}acetamide
Comments Computed using HOSE algorithm
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Exact Mass 291.104147971 u
Formula C14H17N3O2S
InChI InChI=1S/C14H17N3O2S/c1-8-4-5-10(9(2)6-8)16-12(18)7-11-13(19)17-14(15-3)20-11/h4-6,11H,7H2,1-3H3,(H,16,18)(H,15,17,19)
InChIKey VIMVYNISHQAXDX-UHFFFAOYSA-N
Molecular Weight 291.369 g/mol
SMILES N(C(CC1S\C(NC1=O)=N/C)=O)C1=C(C=C(C=C1)C)C