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1(2H)-Pyrazinecarboxylic acid, 4-(5-chloro-4-cyano-2-fluorophenyl)tetrahydro-, ethyl ester

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

1(2H)-Pyrazinecarboxylic acid, 4-(5-chloro-4-cyano-2-fluorophenyl)tetrahydro-, ethyl ester
SpectraBase Compound ID KZuj3tfCuZq
InChI InChI=1S/C14H15ClFN3O2/c1-2-21-14(20)19-5-3-18(4-6-19)13-8-11(15)10(9-17)7-12(13)16/h7-8H,2-6H2,1H3
InChIKey UMOYZBHUFCDNLZ-UHFFFAOYSA-N
Mol Weight 311.74 g/mol
Molecular Formula C14H15ClFN3O2
Exact Mass 311.083683 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EFLdaxqv3Ap
Name ethyl 4-(5-chloro-4-cyano-2-fluorophenyl)-1-piperazinecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H15ClFN3O2/c1-2-21-14(20)19-5-3-18(4-6-19)13-8-11(15)10(9-17)7-12(13)16/h7-8H,2-6H2,1H3
InChIKey UMOYZBHUFCDNLZ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5229
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/11211170; Labnumber: LIP-A001658; IOH_ID: IOH-005230