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4-[3-(4-tert-butylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]-2-chlorophenyl ethyl ether
SpectraBase Compound ID 87MVcnbE1dD
InChI InChI=1S/C22H23ClN4OS/c1-5-28-19-11-8-15(12-17(19)23)18-13-29-21-25-24-20(27(21)26-18)14-6-9-16(10-7-14)22(2,3)4/h6-12H,5,13H2,1-4H3
InChIKey JWJLDPGXIQYHSC-UHFFFAOYSA-N
Mol Weight 426.97 g/mol
Molecular Formula C22H23ClN4OS
Exact Mass 426.12811 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Baaj5yCvjy4
Name 4-[3-(4-tert-butylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]-2-chlorophenyl ethyl ether
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.128110250 u
Formula C22H23ClN4OS
InChI InChI=1S/C22H23ClN4OS/c1-5-28-19-11-8-15(12-17(19)23)18-13-29-21-25-24-20(27(21)26-18)14-6-9-16(10-7-14)22(2,3)4/h6-12H,5,13H2,1-4H3
InChIKey JWJLDPGXIQYHSC-UHFFFAOYSA-N
Molecular Weight 426.966 g/mol
NMR Offset 17.9987
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9804
Solvent DMSO-d6
Source Vendor ID: NMR/13229853