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6-(4-bromobenzyl)-3-thioxo-2H-1,2,4-triazin-5-one

View entire compound with spectra: 1 MS (GC)

6-(4-bromobenzyl)-3-thioxo-2H-1,2,4-triazin-5-one
SpectraBase Compound ID ClU3ZWSY9dW
InChI InChI=1S/C10H8BrN3OS/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 HNZSPWFHXKYDCE-UHFFFAOYSA-N
Mol Weight 298.16 g/mol
Molecular Formula C10H8BrN3OS
Exact Mass 296.957146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MssakLT9c
Name 6-(4-bromobenzyl)-3-thioxo-2H-1,2,4-triazin-5-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8BrN3OS
InChI InChI=1S/C10H8BrN3OS/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 HNZSPWFHXKYDCE-UHFFFAOYSA-N
Molecular Weight 298.158 g/mol
SMILES N1C(NC(C(=N1)Cc1ccc(cc1)Br)=O)=S
SPLASH splash10-0005-8790000000-d6f3fb59521ce2f07b99
Source of Spectrum F7-7-319-5
Synonyms 6-[(4-bromophenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one 6-[(4-bromophenyl)methyl]-3-thioxo-2H-1,2,4-triazin-5-one
Wiley ID 1556588