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7-AMINO-6-(p-CHLOROPHENYL)-2-[(2,6-DICHLOROBENZYL)THIO]-s-TRIAZOLO[1,5-a]PYRIMIDINE
SpectraBase Compound ID 3JzUVUH3PGp
InChI InChI=1S/C18H12Cl3N5S/c19-11-6-4-10(5-7-11)12-8-23-17-24-18(25-26(17)16(12)22)27-9-13-14(20)2-1-3-15(13)21/h1-8H,9,22H2
InChIKey JGKGLUNSIUYKCW-UHFFFAOYSA-N
Mol Weight 436.75 g/mol
Molecular Formula C18H12Cl3N5S
Exact Mass 434.9879 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JKF9wEj6Z4G
Name 7-AMINO-6-(p-CHLOROPHENYL)-2-[(2,6-DICHLOROBENZYL)THIO]-s-TRIAZOLO[1,5-a]PYRIMIDINE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12Cl3N5S
InChI InChI=1S/C18H12Cl3N5S/c19-11-6-4-10(5-7-11)12-8-23-17-24-18(25-26(17)16(12)22)27-9-13-14(20)2-1-3-15(13)21/h1-8H,9,22H2
InChIKey JGKGLUNSIUYKCW-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 258-260C
Molecular Weight 436.75
Solvent DMSO-d6; Reference=TMS; Temperature 297K