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propanamide, 2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-N-(2,4,6-trimethylphenyl)-
SpectraBase Compound ID ADAO9usZEKg
InChI InChI=1S/C26H25FN4OS/c1-16-13-17(2)23(18(3)14-16)28-25(32)19(4)33-26-30-29-24(20-9-8-10-21(27)15-20)31(26)22-11-6-5-7-12-22/h5-15,19H,1-4H3,(H,28,32)
InChIKey KFDMPMZLNZOTCI-UHFFFAOYSA-N
Mol Weight 460.57 g/mol
Molecular Formula C26H25FN4OS
Exact Mass 460.173311 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AcydJyxK3P5
Name propanamide, 2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-N-(2,4,6-trimethylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.173310777 u
Formula C26H25FN4OS
InChI InChI=1S/C26H25FN4OS/c1-16-13-17(2)23(18(3)14-16)28-25(32)19(4)33-26-30-29-24(20-9-8-10-21(27)15-20)31(26)22-11-6-5-7-12-22/h5-15,19H,1-4H3,(H,28,32)
InChIKey KFDMPMZLNZOTCI-UHFFFAOYSA-N
Molecular Weight 460.571 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13378
Solvent DMSO-d6
Source Vendor ID: NMR/10300047; Lab Info: LP; Lab Number: LP-205217