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Propionic acid, 3,3,3-trifluoro-2-(4-methylpyridin-2-ylamino)-2-pentanoylamino-, ethyl ester

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Propionic acid, 3,3,3-trifluoro-2-(4-methylpyridin-2-ylamino)-2-pentanoylamino-, ethyl ester
SpectraBase Compound ID DfjkmSiKPqh
InChI InChI=1S/C16H22F3N3O3/c1-4-6-7-13(23)22-15(16(17,18)19,14(24)25-5-2)21-12-10-11(3)8-9-20-12/h8-10H,4-7H2,1-3H3,(H,20,21)(H,22,23)
InChIKey JEFSNYCLVVWYEK-UHFFFAOYSA-N
Mol Weight 361.37 g/mol
Molecular Formula C16H22F3N3O3
Exact Mass 361.161326 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID edE8FLINHM
Name alanine, 3,3,3-trifluoro-N-(4-methyl-2-pyridinyl)-2-[(1-oxopentyl)amino]-, ethyl 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 361.161326066 u
Formula C16H22F3N3O3
InChI InChI=1S/C16H22F3N3O3/c1-4-6-7-13(23)22-15(16(17,18)19,14(24)25-5-2)21-12-10-11(3)8-9-20-12/h8-10H,4-7H2,1-3H3,(H,20,21)(H,22,23)
InChIKey JEFSNYCLVVWYEK-UHFFFAOYSA-N
Molecular Weight 361.365 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11443
Solvent DMSO-d6
Source Vendor ID: NMR/10261428; Lab Info: AU; Lab Number: AU-SG00173