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6-[2-nitro-4-(trifluoromethyl)anilino]hexanoic acid

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6-[2-nitro-4-(trifluoromethyl)anilino]hexanoic acid
SpectraBase Compound ID jIMMdaFbyP
InChI InChI=1S/C13H15F3N2O4/c14-13(15,16)9-5-6-10(11(8-9)18(21)22)17-7-3-1-2-4-12(19)20/h5-6,8,17H,1-4,7H2,(H,19,20)
InChIKey VEUVISZLWLNGMK-UHFFFAOYSA-N
Mol Weight 320.27 g/mol
Molecular Formula C13H15F3N2O4
Exact Mass 320.098391 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JWsolwUpYMd
Name 6-[2-nitro-4-(trifluoromethyl)anilino]hexanoic 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/C13H15F3N2O4/c14-13(15,16)9-5-6-10(11(8-9)18(21)22)17-7-3-1-2-4-12(19)20/h5-6,8,17H,1-4,7H2,(H,19,20)
InChIKey VEUVISZLWLNGMK-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_970
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: ZI/7109561; Labnumber: LP-1400787; IOH_ID: IOH-000971
Temperature 303 °C