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1H-1,2,4-triazol-5-amine, 3-(4-chlorophenyl)-1-[(3,4-dimethoxyphenyl)acetyl]-N-(2-furanylmethyl)-
SpectraBase Compound ID rxT1noBJxi
InChI InChI=1S/C23H21ClN4O4/c1-30-19-10-5-15(12-20(19)31-2)13-21(29)28-23(25-14-18-4-3-11-32-18)26-22(27-28)16-6-8-17(24)9-7-16/h3-12H,13-14H2,1-2H3,(H,25,26,27)
InChIKey CFDAPMINNHBEAB-UHFFFAOYSA-N
Mol Weight 452.9 g/mol
Molecular Formula C23H21ClN4O4
Exact Mass 452.125133 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AvuZ4MBQbTe
Name 1H-1,2,4-triazol-5-amine, 3-(4-chlorophenyl)-1-[(3,4-dimethoxyphenyl)acetyl]-N-(2-furanylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.125132868 u
Formula C23H21ClN4O4
InChI InChI=1S/C23H21ClN4O4/c1-30-19-10-5-15(12-20(19)31-2)13-21(29)28-23(25-14-18-4-3-11-32-18)26-22(27-28)16-6-8-17(24)9-7-16/h3-12H,13-14H2,1-2H3,(H,25,26,27)
InChIKey CFDAPMINNHBEAB-UHFFFAOYSA-N
Molecular Weight 452.898 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7779
Solvent DMSO-d6
Source Vendor ID: NMR/13308620