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6-(4-Chlorobenzyl)-3-thioxo-2H-1,2,4-triazin-5-one
SpectraBase Compound ID 7QkF9GzJQfS
InChI InChI=1S/C10H8ClN3OS/c11-7-3-1-6(2-4-7)5-8-9(15)12-10(16)14-13-8/h1-4H,5H2,(H2,12,14,15,16)
InChIKey ZQJQEUZXCSZUAW-UHFFFAOYSA-N
Mol Weight 253.71 g/mol
Molecular Formula C10H8ClN3OS
Exact Mass 253.007661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WPBAvIz8S
Name 6-(4-Chlorobenzyl)-3-thioxo-2H-1,2,4-triazin-5-one
Alternate Name(s) 6-[(4-chlorophenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one 6-[(4-chlorophenyl)methyl]-3-thioxo-2H-1,2,4-triazin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8ClN3OS
InChI InChI=1S/C10H8ClN3OS/c11-7-3-1-6(2-4-7)5-8-9(15)12-10(16)14-13-8/h1-4H,5H2,(H2,12,14,15,16)
InChIKey ZQJQEUZXCSZUAW-UHFFFAOYSA-N
Molecular Weight 253.707 g/mol
SMILES N1C(NC(C(=N1)Cc1ccc(cc1)Cl)=O)=S
SPLASH splash10-0ufu-7690000000-e751afc8e5dbe039f404
Source of Spectrum F7-7-318-5
Wiley ID 1556589