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benzo[4,5]thieno[2,3-d]pyrimidine, 5,6,7,8-tetrahydro-4-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-
SpectraBase Compound ID 11jo3chE31l
InChI InChI=1S/C21H21F3N4S/c22-21(23,24)14-4-3-5-15(12-14)27-8-10-28(11-9-27)19-18-16-6-1-2-7-17(16)29-20(18)26-13-25-19/h3-5,12-13H,1-2,6-11H2
InChIKey XVEXMTBXVSDIDR-UHFFFAOYSA-N
Mol Weight 418.48 g/mol
Molecular Formula C21H21F3N4S
Exact Mass 418.143902 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 78MJrQbuMKc
Name benzo[4,5]thieno[2,3-d]pyrimidine, 5,6,7,8-tetrahydro-4-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-
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/C21H21F3N4S/c22-21(23,24)14-4-3-5-15(12-14)27-8-10-28(11-9-27)19-18-16-6-1-2-7-17(16)29-20(18)26-13-25-19/h3-5,12-13H,1-2,6-11H2
InChIKey XVEXMTBXVSDIDR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_716
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/11228393