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2,2,2-trifluoroacetic acid compound with 3-(1H-indol-3-yl)-2-((3-(4-(isopentyloxy)phenyl)-3-oxopropyl)amino)propanoic acid (1:1)

View entire compound with spectra: 1 NMR

2,2,2-trifluoroacetic acid compound with 3-(1H-indol-3-yl)-2-((3-(4-(isopentyloxy)phenyl)-3-oxopropyl)amino)propanoic acid (1:1)
SpectraBase Compound ID 1wrrveUOIrd
InChI InChI=1S/C25H30N2O4.C2HF3O2/c1-17(2)12-14-31-20-9-7-18(8-10-20)24(28)11-13-26-23(25(29)30)15-19-16-27-22-6-4-3-5-21(19)22;3-2(4,5)1(6)7/h3-10,16-17,23,26-27H,11-15H2,1-2H3,(H,29,30);(H,6,7)
InChIKey HQMVVFSENXAZSX-UHFFFAOYSA-N
Mol Weight 536.55 g/mol
Molecular Formula C27H31F3N2O6
Exact Mass 536.213421 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AVP7ZBerskt
Name 2,2,2-trifluoroacetic acid compound with 3-(1H-indol-3-yl)-2-((3-(4-(isopentyloxy)phenyl)-3-oxopropyl)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/C25H30N2O4.C2HF3O2/c1-17(2)12-14-31-20-9-7-18(8-10-20)24(28)11-13-26-23(25(29)30)15-19-16-27-22-6-4-3-5-21(19)22;3-2(4,5)1(6)7/h3-10,16-17,23,26-27H,11-15H2,1-2H3,(H,29,30);(H,6,7)
InChIKey HQMVVFSENXAZSX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_5676
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/11288466