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3,3,3-Trifluoro-2-(2-methoxy-benzoylamino)-2-(N'-phenyl-hydrazino)-propionic acid methyl ester
SpectraBase Compound ID HhZUQcHclsJ
InChI InChI=1S/C18H18F3N3O4/c1-27-14-11-7-6-10-13(14)15(25)22-17(16(26)28-2,18(19,20)21)24-23-12-8-4-3-5-9-12/h3-11,23-24H,1-2H3,(H,22,25)
InChIKey INBKPITWIDRDRM-UHFFFAOYSA-N
Mol Weight 397.35 g/mol
Molecular Formula C18H18F3N3O4
Exact Mass 397.124941 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2pLovzEA8eV
Name alanine, 3,3,3-trifluoro-N-(2-methoxybenzoyl)-2-(2-phenylhydrazino)-,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 397.124940557 u
Formula C18H18F3N3O4
InChI InChI=1S/C18H18F3N3O4/c1-27-14-11-7-6-10-13(14)15(25)22-17(16(26)28-2,18(19,20)21)24-23-12-8-4-3-5-9-12/h3-11,23-24H,1-2H3,(H,22,25)
InChIKey INBKPITWIDRDRM-UHFFFAOYSA-N
Molecular Weight 397.354 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15086
Solvent DMSO-d6
Source Vendor ID: NMR/10321906; Lab Info: AU; Lab Number: AU-CG00230