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propyl 2-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SpectraBase Compound ID 6nNEgzdpIAQ
InChI InChI=1S/C20H24F3N3O3S/c1-3-9-29-19(28)17-13-7-5-4-6-8-14(13)30-18(17)24-16(27)11-26-12(2)10-15(25-26)20(21,22)23/h10H,3-9,11H2,1-2H3,(H,24,27)
InChIKey HQNQZCDHFHENSE-UHFFFAOYSA-N
Mol Weight 443.49 g/mol
Molecular Formula C20H24F3N3O3S
Exact Mass 443.149047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 13oMjP5N0ez
Name propyl 2-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[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/C20H24F3N3O3S/c1-3-9-29-19(28)17-13-7-5-4-6-8-14(13)30-18(17)24-16(27)11-26-12(2)10-15(25-26)20(21,22)23/h10H,3-9,11H2,1-2H3,(H,24,27)
InChIKey HQNQZCDHFHENSE-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12863
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: UZI/8161635; UBI_ID: UBI-012866
Temperature 308 °C