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Methyl (2R,4R)-2-(4-methoxybenzoyl)thiazolidine-4-carboxylate

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

Methyl (2R,4R)-2-(4-methoxybenzoyl)thiazolidine-4-carboxylate
SpectraBase Compound ID Bvt0CgDlOAs
InChI InChI=1S/C13H15NO4S/c1-17-9-5-3-8(4-6-9)11(15)12-14-10(7-19-12)13(16)18-2/h3-6,10,12,14H,7H2,1-2H3/t10-,12+/m0/s1
InChIKey PFLGOBRSCZQBGW-CMPLNLGQSA-N
Mol Weight 281.33 g/mol
Molecular Formula C13H15NO4S
Exact Mass 281.072179 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E5HQYOOwdew
Name Methyl (2R,4R)-2-(4-methoxybenzoyl)thiazolidine-4-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.072179137 u
Formula C13H15NO4S
InChI InChI=1S/C13H15NO4S/c1-17-9-5-3-8(4-6-9)11(15)12-14-10(7-19-12)13(16)18-2/h3-6,10,12,14H,7H2,1-2H3/t10-,12+/m0/s1
InChIKey PFLGOBRSCZQBGW-CMPLNLGQSA-N
SMILES [C@]1(SC[C@](N1)(C(=O)OC)[H])(C(C=1C=CC(=CC1)OC)=O)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973769