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carbamimidothioic acid, N'-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-, 1-(4-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl ester

View entire compound with spectra: 1 NMR

carbamimidothioic acid, N'-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-, 1-(4-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl ester
SpectraBase Compound ID II2sBGdi66I
InChI InChI=1S/C26H23F2N3O3S/c1-34-22-12-2-17(3-13-22)14-15-29-26(30-20-8-4-18(27)5-9-20)35-23-16-24(32)31(25(23)33)21-10-6-19(28)7-11-21/h2-13,23H,14-16H2,1H3,(H,29,30)
InChIKey LGSHATBNIUEKBW-UHFFFAOYSA-N
Mol Weight 495.54 g/mol
Molecular Formula C26H23F2N3O3S
Exact Mass 495.142819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E7Ev9Rw8NBg
Name carbamimidothioic acid, N'-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-, 1-(4-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl ester
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/C26H23F2N3O3S/c1-34-22-12-2-17(3-13-22)14-15-29-26(30-20-8-4-18(27)5-9-20)35-23-16-24(32)31(25(23)33)21-10-6-19(28)7-11-21/h2-13,23H,14-16H2,1H3,(H,29,30)
InChIKey LGSHATBNIUEKBW-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_2391
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: NMR/9251685; Labnumber: L-04,Polunin
Temperature 297 °C