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alanine, 3,3,3-trifluoro-N-(1-oxopropyl)-, ethyl ester
SpectraBase Compound ID GrXdEGWOYrx
InChI InChI=1S/C8H12F3NO3/c1-3-5(13)12-6(8(9,10)11)7(14)15-4-2/h6H,3-4H2,1-2H3,(H,12,13)
InChIKey DMQSTVIOYLFAJS-UHFFFAOYSA-N
Mol Weight 227.18 g/mol
Molecular Formula C8H12F3NO3
Exact Mass 227.076928 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 13XhRgsDbtw
Name alanine, 3,3,3-trifluoro-N-(1-oxopropyl)-, 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/C8H12F3NO3/c1-3-5(13)12-6(8(9,10)11)7(14)15-4-2/h6H,3-4H2,1-2H3,(H,12,13)
InChIKey DMQSTVIOYLFAJS-UHFFFAOYSA-N
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_CB_8313_472
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/8325622; Labnumber: AU-0000530
Temperature 313 °C