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alanine, N-(4,6-dimethyl-2-pyridinyl)-3,3,3-trifluoro-2-[(4-methylbenzoyl)amino]-, methyl ester
SpectraBase Compound ID 4DFmWulgU9h
InChI InChI=1S/C19H20F3N3O3/c1-11-5-7-14(8-6-11)16(26)25-18(17(27)28-4,19(20,21)22)24-15-10-12(2)9-13(3)23-15/h5-10H,1-4H3,(H,23,24)(H,25,26)
InChIKey QZELCGVFMMBQBT-UHFFFAOYSA-N
Mol Weight 395.38 g/mol
Molecular Formula C19H20F3N3O3
Exact Mass 395.145676 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B456a98ygvS
Name alanine, N-(4,6-dimethyl-2-pyridinyl)-3,3,3-trifluoro-2-[(4-methylbenzoyl)amino]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.145676002 u
Formula C19H20F3N3O3
InChI InChI=1S/C19H20F3N3O3/c1-11-5-7-14(8-6-11)16(26)25-18(17(27)28-4,19(20,21)22)24-15-10-12(2)9-13(3)23-15/h5-10H,1-4H3,(H,23,24)(H,25,26)
InChIKey QZELCGVFMMBQBT-UHFFFAOYSA-N
Molecular Weight 395.382 g/mol
NMR Offset 17.9888
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6174
Solvent CDCl3
Source Vendor ID: NMR/11222367; Lab Info: AU; Lab Number: AU-P000267