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1-{2-oxo-2-[4-(2-thienylmethyl)-1-piperazinyl]ethyl}-3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole
SpectraBase Compound ID Bt9Vts59p0Z
InChI InChI=1S/C18H21F3N4OS/c19-18(20,21)17-14-4-1-5-15(14)25(22-17)12-16(26)24-8-6-23(7-9-24)11-13-3-2-10-27-13/h2-3,10H,1,4-9,11-12H2
InChIKey DFQQJDULSGPSMI-UHFFFAOYSA-N
Mol Weight 398.45 g/mol
Molecular Formula C18H21F3N4OS
Exact Mass 398.138817 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Co9sIroJMFZ
Name 1-{2-oxo-2-[4-(2-thienylmethyl)-1-piperazinyl]ethyl}-3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole
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/C18H21F3N4OS/c19-18(20,21)17-14-4-1-5-15(14)25(22-17)12-16(26)24-8-6-23(7-9-24)11-13-3-2-10-27-13/h2-3,10H,1,4-9,11-12H2
InChIKey DFQQJDULSGPSMI-UHFFFAOYSA-N
NMR Offset 15.3209
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34094
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: 2055794; SBI_ID: SBI-034098
Temperature 297 °C