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{(5Z)-5-[4-(allyloxy)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetic acid
SpectraBase Compound ID HOBjonHpsOc
InChI InChI=1S/C15H13NO5S/c1-2-7-21-11-5-3-10(4-6-11)8-12-14(19)16(9-13(17)18)15(20)22-12/h2-6,8H,1,7,9H2,(H,17,18)/b12-8-
InChIKey YBZCFSOHVGOTJJ-WQLSENKSSA-N
Mol Weight 319.33 g/mol
Molecular Formula C15H13NO5S
Exact Mass 319.051444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A4aeLCUZvSd
Name {(5Z)-5-[4-(Allyloxy)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.051443692 u
Formula C15H13NO5S
InChI InChI=1S/C15H13NO5S/c1-2-7-21-11-5-3-10(4-6-11)8-12-14(19)16(9-13(17)18)15(20)22-12/h2-6,8H,1,7,9H2,(H,17,18)/b12-8-
InChIKey YBZCFSOHVGOTJJ-WQLSENKSSA-N
Molecular Weight 319.331 g/mol
SMILES OC(CN1C(S\C(C1=O)=C\C=1C=CC(=CC1)OCC=C)=O)=O