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acetamide, 2-[(3,5,6,7-tetrahydro-4-oxo-3-phenyl-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]-N-[2-(trifluoromethyl)phenyl]-
SpectraBase Compound ID DreyzhJfJ7E
InChI InChI=1S/C24H18F3N3O2S2/c25-24(26,27)16-10-4-5-11-17(16)28-19(31)13-33-23-29-21-20(15-9-6-12-18(15)34-21)22(32)30(23)14-7-2-1-3-8-14/h1-5,7-8,10-11H,6,9,12-13H2,(H,28,31)
InChIKey FBSJABIWUQINHL-UHFFFAOYSA-N
Mol Weight 501.54 g/mol
Molecular Formula C24H18F3N3O2S2
Exact Mass 501.079254 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3rcLhLLnk4r
Name acetamide, 2-[(3,5,6,7-tetrahydro-4-oxo-3-phenyl-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]-N-[2-(trifluoromethyl)phenyl]-
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/C24H18F3N3O2S2/c25-24(26,27)16-10-4-5-11-17(16)28-19(31)13-33-23-29-21-20(15-9-6-12-18(15)34-21)22(32)30(23)14-7-2-1-3-8-14/h1-5,7-8,10-11H,6,9,12-13H2,(H,28,31)
InChIKey FBSJABIWUQINHL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_855
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/11228543