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1-METHYL-5-NITRO-4-PHENYLTHIOIMIDAZOLE
SpectraBase Compound ID EaBpSj366B9
InChI InChI=1S/C10H9N3O2S/c1-12-7-11-9(10(12)13(14)15)16-8-5-3-2-4-6-8/h2-7H,1H3
InChIKey HGUUELZEVIHNMB-UHFFFAOYSA-N
Mol Weight 235.26 g/mol
Molecular Formula C10H9N3O2S
Exact Mass 235.041548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7dgNnmwZmw
Name 1H-Imidazole, 1-methyl-5-nitro-4-(phenylthio)-
CAS Registry Number 32057-98-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N3O2S
InChI InChI=1S/C10H9N3O2S/c1-12-7-11-9(10(12)13(14)15)16-8-5-3-2-4-6-8/h2-7H,1H3
InChIKey HGUUELZEVIHNMB-UHFFFAOYSA-N
Molecular Weight 235.261 g/mol
SMILES c1(c(nc[n]1C)Sc1ccccc1)N(=O)=O
SPLASH splash10-000i-0490000000-4992dc8b9322835cf50c
Source of Spectrum B-40-1421-0
Synonyms Imidazole, 1-methyl-5-nitro-4-(phenylthio)- 1-Methyl-5-nitro-1H-imidazol-4-yl phenyl sulfide 1-Methyl-5-nitro-4-(phenylsulfanyl)-1H-imidazole 1-Methyl-5-nitro-4-(phenylthio)imidazole
Wiley ID 1236869