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3H-1,2,4-triazole-3-thione, 5-[(3,4-dimethylphenoxy)methyl]-2,4-dihydro-4-methyl-2-[(4-phenyl-1-piperidinyl)methyl]-
SpectraBase Compound ID 2GSMoE734uf
InChI InChI=1S/C24H30N4OS/c1-18-9-10-22(15-19(18)2)29-16-23-25-28(24(30)26(23)3)17-27-13-11-21(12-14-27)20-7-5-4-6-8-20/h4-10,15,21H,11-14,16-17H2,1-3H3
InChIKey AATLDPUMYIIZEU-UHFFFAOYSA-N
Mol Weight 422.59 g/mol
Molecular Formula C24H30N4OS
Exact Mass 422.214033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6kbGKtVbndR
Name 3H-1,2,4-triazole-3-thione, 5-[(3,4-dimethylphenoxy)methyl]-2,4-dihydro-4-methyl-2-[(4-phenyl-1-piperidinyl)methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.214032775 u
Formula C24H30N4OS
InChI InChI=1S/C24H30N4OS/c1-18-9-10-22(15-19(18)2)29-16-23-25-28(24(30)26(23)3)17-27-13-11-21(12-14-27)20-7-5-4-6-8-20/h4-10,15,21H,11-14,16-17H2,1-3H3
InChIKey AATLDPUMYIIZEU-UHFFFAOYSA-N
Molecular Weight 422.591 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2587
Solvent DMSO-d6
Source Vendor ID: NMR/9234650; Lab Info: LP; Lab Number: LP-2190481
Temperature 29.85 °C