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5-amino-1-[2-(2,4-difluoroanilino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID GRd1X0rdRt8
InChI InChI=1S/C19H18F2N6O2/c1-10-3-5-13(7-11(10)2)23-19(29)17-18(22)27(26-25-17)9-16(28)24-15-6-4-12(20)8-14(15)21/h3-8H,9,22H2,1-2H3,(H,23,29)(H,24,28)
InChIKey RKLXXSHSEVYGEX-UHFFFAOYSA-N
Mol Weight 400.39 g/mol
Molecular Formula C19H18F2N6O2
Exact Mass 400.14593 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5ovsMXR2dFA
Name 5-amino-1-[2-(2,4-difluoroanilino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.145930168 u
Formula C19H18F2N6O2
InChI InChI=1S/C19H18F2N6O2/c1-10-3-5-13(7-11(10)2)23-19(29)17-18(22)27(26-25-17)9-16(28)24-15-6-4-12(20)8-14(15)21/h3-8H,9,22H2,1-2H3,(H,23,29)(H,24,28)
InChIKey RKLXXSHSEVYGEX-UHFFFAOYSA-N
Molecular Weight 400.390 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6597
Solvent DMSO-d6
Source Vendor ID: NMR/12328854