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ethyl 4-[2,5-dioxo-3-(2-pyrimidinylsulfanyl)-1-pyrrolidinyl]benzoate
SpectraBase Compound ID 5RqvrBmBUWL
InChI InChI=1S/C17H15N3O4S/c1-2-24-16(23)11-4-6-12(7-5-11)20-14(21)10-13(15(20)22)25-17-18-8-3-9-19-17/h3-9,13H,2,10H2,1H3
InChIKey IGYXCTGHILDOMQ-UHFFFAOYSA-N
Mol Weight 357.38 g/mol
Molecular Formula C17H15N3O4S
Exact Mass 357.078327 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1K0uWbQNeKm
Name ethyl 4-[2,5-dioxo-3-(2-pyrimidinylsulfanyl)-1-pyrrolidinyl]benzoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H15N3O4S/c1-2-24-16(23)11-4-6-12(7-5-11)20-14(21)10-13(15(20)22)25-17-18-8-3-9-19-17/h3-9,13H,2,10H2,1H3
InChIKey IGYXCTGHILDOMQ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6968
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D27287; Labnumber: VGU-18486; SBI_ID: SBI-006971
Temperature 315 °C