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5-(1-Methyl-4-nitro-2-pyrrolyl)-3H-1,3,4-oxadiazole-2-thione
SpectraBase Compound ID 3UfIM1tyUoa
InChI InChI=1S/C7H6N4O3S/c1-10-3-4(11(12)13)2-5(10)6-8-9-7(15)14-6/h2-3H,1H3,(H,9,15)
InChIKey JDBGXHYYBGYXLO-UHFFFAOYSA-N
Mol Weight 226.21 g/mol
Molecular Formula C7H6N4O3S
Exact Mass 226.016061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8GGXWqXkPR
Name 5-(1-Methyl-4-nitro-2-pyrrolyl)-3H-1,3,4-oxadiazole-2-thione
Alternate Name(s) 5-(1-Methyl-4-nitro-pyrrol-2-yl)-3H-1,3,4-oxadiazole-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6N4O3S
InChI InChI=1S/C7H6N4O3S/c1-10-3-4(11(12)13)2-5(10)6-8-9-7(15)14-6/h2-3H,1H3,(H,9,15)
InChIKey JDBGXHYYBGYXLO-UHFFFAOYSA-N
Molecular Weight 226.210 g/mol
SMILES N1C(OC(=N1)c1cc(N(=O)=O)c[n]1C)=S
SPLASH splash10-00or-2970000000-f497de1f5a184654fb55
Source of Spectrum Y-32-127-13
Wiley ID 1226730