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1-piperazinecarboxylic acid, 4-[1-[4-[(difluoromethyl)thio]phenyl]-2,5-dioxo-3-pyrrolidinyl]-, ethyl ester

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1-piperazinecarboxylic acid, 4-[1-[4-[(difluoromethyl)thio]phenyl]-2,5-dioxo-3-pyrrolidinyl]-, ethyl ester
SpectraBase Compound ID 66nJPjcFK51
InChI InChI=1S/C18H21F2N3O4S/c1-2-27-18(26)22-9-7-21(8-10-22)14-11-15(24)23(16(14)25)12-3-5-13(6-4-12)28-17(19)20/h3-6,14,17H,2,7-11H2,1H3
InChIKey LELFNSBVFIWKKJ-UHFFFAOYSA-N
Mol Weight 413.44 g/mol
Molecular Formula C18H21F2N3O4S
Exact Mass 413.122084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FtGVIIlMHur
Name 1-piperazinecarboxylic acid, 4-[1-[4-[(difluoromethyl)thio]phenyl]-2,5-dioxo-3-pyrrolidinyl]-, ethyl 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/C18H21F2N3O4S/c1-2-27-18(26)22-9-7-21(8-10-22)14-11-15(24)23(16(14)25)12-3-5-13(6-4-12)28-17(19)20/h3-6,14,17H,2,7-11H2,1H3
InChIKey LELFNSBVFIWKKJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1322
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: F08406; Labnumber: DRAP-01863