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acetamide, 2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-N-[2-(1-methylethoxy)phenyl]-
SpectraBase Compound ID Gvhluk7bgK2
InChI InChI=1S/C25H23FN4O2S/c1-17(2)32-22-14-7-6-13-21(22)27-23(31)16-33-25-29-28-24(18-9-8-10-19(26)15-18)30(25)20-11-4-3-5-12-20/h3-15,17H,16H2,1-2H3,(H,27,31)
InChIKey JAQMSMDTSRTYAG-UHFFFAOYSA-N
Mol Weight 462.54 g/mol
Molecular Formula C25H23FN4O2S
Exact Mass 462.152575 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AaM0vmdrsKo
Name acetamide, 2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-N-[2-(1-methylethoxy)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 462.152575332 u
Formula C25H23FN4O2S
InChI InChI=1S/C25H23FN4O2S/c1-17(2)32-22-14-7-6-13-21(22)27-23(31)16-33-25-29-28-24(18-9-8-10-19(26)15-18)30(25)20-11-4-3-5-12-20/h3-15,17H,16H2,1-2H3,(H,27,31)
InChIKey JAQMSMDTSRTYAG-UHFFFAOYSA-N
Molecular Weight 462.543 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13382
Solvent DMSO-d6
Source Vendor ID: NMR/10300051; Lab Info: LP; Lab Number: LP-205222