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1-{[5-(4-methoxyphenyl)-2-furyl]carbothioyl}-4-[3-(trifluoromethyl)phenyl]piperazine
SpectraBase Compound ID BXyoIUTYs1e
InChI InChI=1S/C23H21F3N2O2S/c1-29-19-7-5-16(6-8-19)20-9-10-21(30-20)22(31)28-13-11-27(12-14-28)18-4-2-3-17(15-18)23(24,25)26/h2-10,15H,11-14H2,1H3
InChIKey HAPRPPPTPMZANX-UHFFFAOYSA-N
Mol Weight 446.49 g/mol
Molecular Formula C23H21F3N2O2S
Exact Mass 446.127584 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hyp00Atu4vg
Name 1-{[5-(4-methoxyphenyl)-2-furyl]carbothioyl}-4-[3-(trifluoromethyl)phenyl]piperazine
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/C23H21F3N2O2S/c1-29-19-7-5-16(6-8-19)20-9-10-21(30-20)22(31)28-13-11-27(12-14-28)18-4-2-3-17(15-18)23(24,25)26/h2-10,15H,11-14H2,1H3
InChIKey HAPRPPPTPMZANX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21067
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: D51733; Labnumber: VLMF-0035; SBI_ID: SBI-021071
Synonyms methyl 4-[5-({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}carbothioyl)-2-furyl]phenyl ether
Temperature 308 °C