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2,2,2-trifluoroacetic acid compound with 2-((3-oxo-3-(4-propoxyphenyl)propyl)amino)propanoic acid (1:1)
SpectraBase Compound ID 7YcRTh6Um49
InChI InChI=1S/C15H21NO4.C2HF3O2/c1-3-10-20-13-6-4-12(5-7-13)14(17)8-9-16-11(2)15(18)19;3-2(4,5)1(6)7/h4-7,11,16H,3,8-10H2,1-2H3,(H,18,19);(H,6,7)
InChIKey PUXCQWLCJGSINY-UHFFFAOYSA-N
Mol Weight 393.36 g/mol
Molecular Formula C17H22F3NO6
Exact Mass 393.139922 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F7cDfsPKvXq
Name 2,2,2-trifluoroacetic acid compound with 2-((3-oxo-3-(4-propoxyphenyl)propyl)amino)propanoic 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/C15H21NO4.C2HF3O2/c1-3-10-20-13-6-4-12(5-7-13)14(17)8-9-16-11(2)15(18)19;3-2(4,5)1(6)7/h4-7,11,16H,3,8-10H2,1-2H3,(H,18,19);(H,6,7)
InChIKey PUXCQWLCJGSINY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_5673
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/11288462