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p-(3,5-Dioxothiomorpholino)benzoic acid, ethyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

p-(3,5-Dioxothiomorpholino)benzoic acid, ethyl ester
SpectraBase Compound ID 1sMZewpmA00
InChI InChI=1S/C13H13NO4S/c1-2-18-13(17)9-3-5-10(6-4-9)14-11(15)7-19-8-12(14)16/h3-6H,2,7-8H2,1H3
InChIKey DPBQUURQOOBEID-UHFFFAOYSA-N
Mol Weight 279.31 g/mol
Molecular Formula C13H13NO4S
Exact Mass 279.056529 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GhTT7bGoM1c
Name p-(3,5-DIOXOTHIOMORPHOLINO)BENZOIC ACID, ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO4S
InChI InChI=1S/C13H13NO4S/c1-2-18-13(17)9-3-5-10(6-4-9)14-11(15)7-19-8-12(14)16/h3-6H,2,7-8H2,1H3
InChIKey DPBQUURQOOBEID-UHFFFAOYSA-N
Melting Point 134C
Molecular Weight 279.32
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, P-/3,5-DIOXOTHIOMORPHOLINO/-, ETHYL ESTER