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acetamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID 1P8ap3x6NYW
InChI InChI=1S/C26H25FN4O3S/c1-33-22-12-11-18(15-23(22)34-2)13-14-28-24(32)17-35-26-30-29-25(19-7-6-8-20(27)16-19)31(26)21-9-4-3-5-10-21/h3-12,15-16H,13-14,17H2,1-2H3,(H,28,32)
InChIKey CHONZSZOGUMNCG-UHFFFAOYSA-N
Mol Weight 492.57 g/mol
Molecular Formula C26H25FN4O3S
Exact Mass 492.16314 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CWjXyNjais8
Name acetamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 492.163140015 u
Formula C26H25FN4O3S
InChI InChI=1S/C26H25FN4O3S/c1-33-22-12-11-18(15-23(22)34-2)13-14-28-24(32)17-35-26-30-29-25(19-7-6-8-20(27)16-19)31(26)21-9-4-3-5-10-21/h3-12,15-16H,13-14,17H2,1-2H3,(H,28,32)
InChIKey CHONZSZOGUMNCG-UHFFFAOYSA-N
Molecular Weight 492.569 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13381
Solvent DMSO-d6
Source Vendor ID: NMR/10300050; Lab Info: LP; Lab Number: LP-205221