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3-(4-Fluoro-benzoyl)-2-p-tolyl-thiazolidine-4-carboxylic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(4-Fluoro-benzoyl)-2-p-tolyl-thiazolidine-4-carboxylic acid
SpectraBase Compound ID DjGnJHP2Lct
InChI InChI=1S/C18H16FNO3S/c1-11-2-4-13(5-3-11)17-20(15(10-24-17)18(22)23)16(21)12-6-8-14(19)9-7-12/h2-9,15,17H,10H2,1H3,(H,22,23)
InChIKey DZTIRHYRVGCXOL-UHFFFAOYSA-N
Mol Weight 345.39 g/mol
Molecular Formula C18H16FNO3S
Exact Mass 345.083493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Jki1t2sQzo
Name 3-(4-Fluoro-benzoyl)-2-p-tolyl-thiazolidine-4-carboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.083492713 u
Formula C18H16FNO3S
InChI InChI=1S/C18H16FNO3S/c1-11-2-4-13(5-3-11)17-20(15(10-24-17)18(22)23)16(21)12-6-8-14(19)9-7-12/h2-9,15,17H,10H2,1H3,(H,22,23)
InChIKey DZTIRHYRVGCXOL-UHFFFAOYSA-N
Molecular Weight 345.388 g/mol
SMILES CC1=CC=C(C2N(C(CS2)C(=O)O)C(C2=CC=C(C=C2)F)=O)C=C1