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butanamide, 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-N-(2-fluorophenyl)-
SpectraBase Compound ID 9VrObHEqB1J
InChI InChI=1S/C26H26FN7OS/c1-4-22(25(35)28-21-12-8-6-10-19(21)27)36-26-29-20-11-7-5-9-18(20)24-30-23(33-34(24)26)14-13-17-15(2)31-32-16(17)3/h5-12,22H,4,13-14H2,1-3H3,(H,28,35)(H,31,32)
InChIKey PKFAHYQXSYFOBD-UHFFFAOYSA-N
Mol Weight 503.6 g/mol
Molecular Formula C26H26FN7OS
Exact Mass 503.190358 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID gB4NAI7hIg
Name butanamide, 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-N-(2-fluorophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 503.190357821 u
Formula C26H26FN7OS
InChI InChI=1S/C26H26FN7OS/c1-4-22(25(35)28-21-12-8-6-10-19(21)27)36-26-29-20-11-7-5-9-18(20)24-30-23(33-34(24)26)14-13-17-15(2)31-32-16(17)3/h5-12,22H,4,13-14H2,1-3H3,(H,28,35)(H,31,32)
InChIKey PKFAHYQXSYFOBD-UHFFFAOYSA-N
Molecular Weight 503.600 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4258
Solvent DMSO-d6
Source Vendor ID: NMR/13279785