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3,6-bis[(4-chlorobenzyl)thio]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID 33T0JdgWIbQ
InChI InChI=1S/C17H12Cl2N4S3/c18-13-5-1-11(2-6-13)9-24-15-20-21-16-23(15)22-17(26-16)25-10-12-3-7-14(19)8-4-12/h1-8H,9-10H2
InChIKey BEXJKJRPHBXKSZ-UHFFFAOYSA-N
Mol Weight 439.4 g/mol
Molecular Formula C17H12Cl2N4S3
Exact Mass 437.960115 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7lRhF9mVZC0
Name [1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3,6-bis[[(4-chlorophenyl)methyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.960115324 u
Formula C17H12Cl2N4S3
InChI InChI=1S/C17H12Cl2N4S3/c18-13-5-1-11(2-6-13)9-24-15-20-21-16-23(15)22-17(26-16)25-10-12-3-7-14(19)8-4-12/h1-8H,9-10H2
InChIKey BEXJKJRPHBXKSZ-UHFFFAOYSA-N
Molecular Weight 439.397 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1166
Solvent DMSO-d6
Source Vendor ID: ZI/8036787; Lab Info: L-42,Shitov; Lab Number: L-42/0002254