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2,6-dimethyl-4-{[5-oxo-5-(2,2,3,3-tetrafluoropropoxy)pentanoyl]amino}benzoic acid
SpectraBase Compound ID PaKtARpqbf
InChI InChI=1S/C17H19F4NO5/c1-9-6-11(7-10(2)14(9)15(25)26)22-12(23)4-3-5-13(24)27-8-17(20,21)16(18)19/h6-7,16H,3-5,8H2,1-2H3,(H,22,23)(H,25,26)
InChIKey IINMLHJHHFIINU-UHFFFAOYSA-N
Mol Weight 393.33 g/mol
Molecular Formula C17H19F4NO5
Exact Mass 393.119935 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BqRLv7mlmNH
Name 2,6-dimethyl-4-{[5-oxo-5-(2,2,3,3-tetrafluoropropoxy)pentanoyl]amino}benzoic 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/C17H19F4NO5/c1-9-6-11(7-10(2)14(9)15(25)26)22-12(23)4-3-5-13(24)27-8-17(20,21)16(18)19/h6-7,16H,3-5,8H2,1-2H3,(H,22,23)(H,25,26)
InChIKey IINMLHJHHFIINU-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9210
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/9042823; UBI_ID: UBI-009213
Temperature 308 °C