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methyl 2-({[1-phenyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID F1UZZtUyF2h
InChI InChI=1S/C22H16F3N3O3S2/c1-31-21(30)16-12-8-5-9-14(12)32-19(16)26-18(29)15-10-13-17(22(23,24)25)27-28(20(13)33-15)11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3,(H,26,29)
InChIKey WGROBUQFESVFBR-UHFFFAOYSA-N
Mol Weight 491.5 g/mol
Molecular Formula C22H16F3N3O3S2
Exact Mass 491.058518 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AGQlAkw3Asv
Name methyl 2-({[1-phenyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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/C22H16F3N3O3S2/c1-31-21(30)16-12-8-5-9-14(12)32-19(16)26-18(29)15-10-13-17(22(23,24)25)27-28(20(13)33-15)11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3,(H,26,29)
InChIKey WGROBUQFESVFBR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32482
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: 1847813; SBI_ID: SBI-032486
Temperature 318 °C