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ethyl 4-(aminocarbonyl)-5-({[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-3-methyl-2-thiophenecarboxylate
SpectraBase Compound ID B9f92gnIbQv
InChI InChI=1S/C18H19F3N4O4S/c1-3-29-17(28)14-8(2)13(15(22)27)16(30-14)23-12(26)7-25-10(9-4-5-9)6-11(24-25)18(19,20)21/h6,9H,3-5,7H2,1-2H3,(H2,22,27)(H,23,26)
InChIKey AZNWAJKWRZIBMV-UHFFFAOYSA-N
Mol Weight 444.43 g/mol
Molecular Formula C18H19F3N4O4S
Exact Mass 444.107911 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4GecfVBjPd9
Name ethyl 4-(aminocarbonyl)-5-({[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-3-methyl-2-thiophenecarboxylate
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/C18H19F3N4O4S/c1-3-29-17(28)14-8(2)13(15(22)27)16(30-14)23-12(26)7-25-10(9-4-5-9)6-11(24-25)18(19,20)21/h6,9H,3-5,7H2,1-2H3,(H2,22,27)(H,23,26)
InChIKey AZNWAJKWRZIBMV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18561
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/1031266; Labnumber: UBI5402; UZI_ID: UZI-018568
Temperature 308 °C