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1-piperidinecarbothioamide, N-(3,4-dimethylphenyl)-4-(5-hydroxy-1-phenyl-1H-pyrazol-3-yl)-
SpectraBase Compound ID JenYoMClxN8
InChI InChI=1S/C23H26N4OS/c1-16-8-9-19(14-17(16)2)24-23(29)26-12-10-18(11-13-26)21-15-22(28)27(25-21)20-6-4-3-5-7-20/h3-9,14-15,18,28H,10-13H2,1-2H3,(H,24,29)
InChIKey ZKWHBSCDGMSCMJ-UHFFFAOYSA-N
Mol Weight 406.55 g/mol
Molecular Formula C23H26N4OS
Exact Mass 406.182733 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EZMgK2l0Llc
Name 1-piperidinecarbothioamide, N-(3,4-dimethylphenyl)-4-(5-hydroxy-1-phenyl-1H-pyrazol-3-yl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.182732646 u
Formula C23H26N4OS
InChI InChI=1S/C23H26N4OS/c1-16-8-9-19(14-17(16)2)24-23(29)26-12-10-18(11-13-26)21-15-22(28)27(25-21)20-6-4-3-5-7-20/h3-9,14-15,18,28H,10-13H2,1-2H3,(H,24,29)
InChIKey ZKWHBSCDGMSCMJ-UHFFFAOYSA-N
Molecular Weight 406.548 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2610
Solvent DMSO-d6
Source Vendor ID: NMR/12688185