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6-{[2-chloro-5-(trifluoromethyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
SpectraBase Compound ID Bi7lyirpjz9
InChI InChI=1S/C15H13ClF3NO3/c16-11-6-5-8(15(17,18)19)7-12(11)20-13(21)9-3-1-2-4-10(9)14(22)23/h1-2,5-7,9-10H,3-4H2,(H,20,21)(H,22,23)
InChIKey XMJBBSPXYYWVOW-UHFFFAOYSA-N
Mol Weight 347.72 g/mol
Molecular Formula C15H13ClF3NO3
Exact Mass 347.053605 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3KG7O43SURF
Name 6-{[2-chloro-5-(trifluoromethyl)anilino]carbonyl}-3-cyclohexene-1-carboxylic acid
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/C15H13ClF3NO3/c16-11-6-5-8(15(17,18)19)7-12(11)20-13(21)9-3-1-2-4-10(9)14(22)23/h1-2,5-7,9-10H,3-4H2,(H,20,21)(H,22,23)
InChIKey XMJBBSPXYYWVOW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5977
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: 62602; UBI_ID: UBI-005979
Temperature 318 °C