For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
{(5E)-5-[2-(benzyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
SpectraBase Compound ID JWFN0MAn00w
InChI InChI=1S/C19H15NO4S2/c21-17(22)11-20-18(23)16(26-19(20)25)10-14-8-4-5-9-15(14)24-12-13-6-2-1-3-7-13/h1-10H,11-12H2,(H,21,22)/b16-10+
InChIKey LTJCAOUYCWAOSI-MHWRWJLKSA-N
Mol Weight 385.45 g/mol
Molecular Formula C19H15NO4S2
Exact Mass 385.04425 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2fiEXYs3S35
Name {(5E)-5-[2-(Benzyloxy)benzylidene]-4-oxo-2-thioxo-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 385.044250311 u
Formula C19H15NO4S2
InChI InChI=1S/C19H15NO4S2/c21-17(22)11-20-18(23)16(26-19(20)25)10-14-8-4-5-9-15(14)24-12-13-6-2-1-3-7-13/h1-10H,11-12H2,(H,21,22)/b16-10+
InChIKey LTJCAOUYCWAOSI-MHWRWJLKSA-N
Molecular Weight 385.452 g/mol
SMILES OC(CN1C(S\C(C1=O)=C/C1=C(OCC=2C=CC=CC2)C=CC=C1)=S)=O