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pyridine, 2,6-bis[[[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]methyl]-
SpectraBase Compound ID DmFU3konGad
InChI InChI=1S/C37H31N7O2S2/c1-45-32-20-16-26(17-21-32)34-39-41-36(43(34)30-12-5-3-6-13-30)47-24-28-10-9-11-29(38-28)25-48-37-42-40-35(27-18-22-33(46-2)23-19-27)44(37)31-14-7-4-8-15-31/h3-23H,24-25H2,1-2H3
InChIKey ZRBHHFQXKQCUEC-UHFFFAOYSA-N
Mol Weight 669.8 g/mol
Molecular Formula C37H31N7O2S2
Exact Mass 669.198066 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LxUJWqDKrbf
Name pyridine, 2,6-bis[[[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]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 669.198065612 u
Formula C37H31N7O2S2
InChI InChI=1S/C37H31N7O2S2/c1-45-32-20-16-26(17-21-32)34-39-41-36(43(34)30-12-5-3-6-13-30)47-24-28-10-9-11-29(38-28)25-48-37-42-40-35(27-18-22-33(46-2)23-19-27)44(37)31-14-7-4-8-15-31/h3-23H,24-25H2,1-2H3
InChIKey ZRBHHFQXKQCUEC-UHFFFAOYSA-N
Molecular Weight 669.822 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14349
Solvent DMSO-d6
Source Vendor ID: NMR/10300046; Lab Info: LP; Lab Number: LP-205213