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4-Amino-2-(4-nitro-benzyl)-2,4-dihydro-[1,2,4]triazole-3-thione
SpectraBase Compound ID HWRJGJ6SWjj
InChI InChI=1S/C9H9N5O2S/c10-12-6-11-13(9(12)17)5-7-1-3-8(4-2-7)14(15)16/h1-4,6H,5,10H2
InChIKey DCLUXEMUZYQZQE-UHFFFAOYSA-N
Mol Weight 251.26 g/mol
Molecular Formula C9H9N5O2S
Exact Mass 251.047696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4T92f7nsmBZ
Name 4-Amino-2-(4-nitro-benzyl)-2,4-dihydro-[1,2,4]triazole-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N5O2S
InChI InChI=1S/C9H9N5O2S/c10-12-6-11-13(9(12)17)5-7-1-3-8(4-2-7)14(15)16/h1-4,6H,5,10H2
InChIKey DCLUXEMUZYQZQE-UHFFFAOYSA-N
Molecular Weight 251.264 g/mol
SMILES NN1C(N(N=C1)Cc1ccc(N(=O)=O)cc1)=S
SPLASH splash10-0udi-9520000000-106962f582f3389e4340
Synonyms 4-Amino-2-(4-nitrobenzyl)-1,2,4-triazole-3-thione 4-Amino-2-(4-nitrobenzyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione 4-Amino-2-[(4-nitrophenyl)methyl]-1,2,4-triazole-3-thione 4-Azanyl-2-[(4-nitrophenyl)methyl]-1,2,4-triazole-3-thione
Wiley ID 1465371