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2,2,2-trifluoroacetic acid compound with 3-((3-oxo-3-(4-propoxyphenyl)propyl)amino)-3-phenylpropanoic acid (1:1)
SpectraBase Compound ID Kj67xhsuQEQ
InChI InChI=1S/C21H25NO4.C2HF3O2/c1-2-14-26-18-10-8-17(9-11-18)20(23)12-13-22-19(15-21(24)25)16-6-4-3-5-7-16;3-2(4,5)1(6)7/h3-11,19,22H,2,12-15H2,1H3,(H,24,25);(H,6,7)
InChIKey DBIJIXKGIBRRHN-UHFFFAOYSA-N
Mol Weight 469.46 g/mol
Molecular Formula C23H26F3NO6
Exact Mass 469.171222 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CkDNgrjJ8HB
Name 2,2,2-trifluoroacetic acid compound with 3-((3-oxo-3-(4-propoxyphenyl)propyl)amino)-3-phenylpropanoic acid (1:1)
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/C21H25NO4.C2HF3O2/c1-2-14-26-18-10-8-17(9-11-18)20(23)12-13-22-19(15-21(24)25)16-6-4-3-5-7-16;3-2(4,5)1(6)7/h3-11,19,22H,2,12-15H2,1H3,(H,24,25);(H,6,7)
InChIKey DBIJIXKGIBRRHN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_5674
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: NMR/11288463