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5-amino-1-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID KKCB4n92z7
InChI InChI=1S/C21H24N6O2/c1-12-8-9-13(2)16(10-12)23-17(28)11-27-20(22)19(25-26-27)21(29)24-18-14(3)6-5-7-15(18)4/h5-10H,11,22H2,1-4H3,(H,23,28)(H,24,29)
InChIKey QOIXDWQCPMIQOB-UHFFFAOYSA-N
Mol Weight 392.46 g/mol
Molecular Formula C21H24N6O2
Exact Mass 392.196074 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ba34iU7n0yj
Name 5-amino-1-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-(2,6-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 392.196074035 u
Formula C21H24N6O2
InChI InChI=1S/C21H24N6O2/c1-12-8-9-13(2)16(10-12)23-17(28)11-27-20(22)19(25-26-27)21(29)24-18-14(3)6-5-7-15(18)4/h5-10H,11,22H2,1-4H3,(H,23,28)(H,24,29)
InChIKey QOIXDWQCPMIQOB-UHFFFAOYSA-N
Molecular Weight 392.463 g/mol
NMR Offset 17.9983
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9760
Solvent DMSO-d6
Source Vendor ID: NMR/13229802