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methyl 2-{[3-(trifluoromethyl)benzoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID EsXtbyvH3fx
InChI InChI=1S/C17H14F3NO3S/c1-24-16(23)13-11-6-3-7-12(11)25-15(13)21-14(22)9-4-2-5-10(8-9)17(18,19)20/h2,4-5,8H,3,6-7H2,1H3,(H,21,22)
InChIKey PFHDFYNSLWECPQ-UHFFFAOYSA-N
Mol Weight 369.36 g/mol
Molecular Formula C17H14F3NO3S
Exact Mass 369.064649 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AsGlkGNJUpx
Name methyl 2-{[3-(trifluoromethyl)benzoyl]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/C17H14F3NO3S/c1-24-16(23)13-11-6-3-7-12(11)25-15(13)21-14(22)9-4-2-5-10(8-9)17(18,19)20/h2,4-5,8H,3,6-7H2,1H3,(H,21,22)
InChIKey PFHDFYNSLWECPQ-UHFFFAOYSA-N
NMR Offset 15.3247
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10513
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/9064754; Labnumber: KOL85-0312; UZI_ID: UZI-010515
Temperature 318 °C