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alanine, 3,3,3-trifluoro-N-(4-fluorobenzoyl)-2-methoxy-, ethyl ester

View entire compound with spectra: 1 NMR

alanine, 3,3,3-trifluoro-N-(4-fluorobenzoyl)-2-methoxy-, ethyl ester
SpectraBase Compound ID 1qmgCeS4vHn
InChI InChI=1S/C13H13F4NO4/c1-3-22-11(20)12(21-2,13(15,16)17)18-10(19)8-4-6-9(14)7-5-8/h4-7H,3H2,1-2H3,(H,18,19)
InChIKey NKVPAYBMJIIRRG-UHFFFAOYSA-N
Mol Weight 323.24 g/mol
Molecular Formula C13H13F4NO4
Exact Mass 323.078071 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8uoI3rIUtWO
Name alanine, 3,3,3-trifluoro-N-(4-fluorobenzoyl)-2-methoxy-, ethyl ester
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/C13H13F4NO4/c1-3-22-11(20)12(21-2,13(15,16)17)18-10(19)8-4-6-9(14)7-5-8/h4-7H,3H2,1-2H3,(H,18,19)
InChIKey NKVPAYBMJIIRRG-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_1603
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/9213081; Labnumber: AU-F000616
Temperature 303 °C