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3H-1,2,4-triazole-3-thione, 2,4-dihydro-5-[[(4-methoxyphenyl)thio]methyl]-2-(4-morpholinylmethyl)-4-phenyl-
SpectraBase Compound ID 4zWkQbR3yir
InChI InChI=1S/C21H24N4O2S2/c1-26-18-7-9-19(10-8-18)29-15-20-22-24(16-23-11-13-27-14-12-23)21(28)25(20)17-5-3-2-4-6-17/h2-10H,11-16H2,1H3
InChIKey UMSKOHLPVBPRHO-UHFFFAOYSA-N
Mol Weight 428.57 g/mol
Molecular Formula C21H24N4O2S2
Exact Mass 428.134068 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FBbhMysWWGo
Name 3H-1,2,4-triazole-3-thione, 2,4-dihydro-5-[[(4-methoxyphenyl)thio]methyl]-2-(4-morpholinylmethyl)-4-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 428.134068375 u
Formula C21H24N4O2S2
InChI InChI=1S/C21H24N4O2S2/c1-26-18-7-9-19(10-8-18)29-15-20-22-24(16-23-11-13-27-14-12-23)21(28)25(20)17-5-3-2-4-6-17/h2-10H,11-16H2,1H3
InChIKey UMSKOHLPVBPRHO-UHFFFAOYSA-N
Molecular Weight 428.569 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10990
Solvent DMSO-d6
Source Vendor ID: NMR/10251182; Lab Info: LP; Lab Number: LP-2100662
Temperature 23.85 °C