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2-(2-Methyltetrazol-5-yl)-2,2-dinitroacetonitrile

View entire compound with spectra: 1 MS (GC)

2-(2-Methyltetrazol-5-yl)-2,2-dinitroacetonitrile
SpectraBase Compound ID 6OLqU4eQeQb
InChI InChI=1S/C4H3N7O4/c1-9-7-3(6-8-9)4(2-5,10(12)13)11(14)15/h1H3
InChIKey ILOZXNRFCOMYNK-UHFFFAOYSA-N
Mol Weight 213.11 g/mol
Molecular Formula C4H3N7O4
Exact Mass 213.024652 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAGKo798ArU
Name 2-(2-Methyltetrazol-5-yl)-2,2-dinitroacetonitrile
Alternate Name(s) 2-(2-Methyltetrazol-5-yl)-2,2-dinitroacetonitrile bromide 2-(2-Methyl-2H-tetrazol-5-yl)-2,2-dinitroacetonitrile 2-(2-Methyl-5-tetrazolyl)-2,2-dinitroacetonitrile 2-(2-Methyl-1,2,3,4-tetrazol-5-yl)-2,2-dinitro-ethanenitrile
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Formula C4H3N7O4
InChI InChI=1S/C4H3N7O4/c1-9-7-3(6-8-9)4(2-5,10(12)13)11(14)15/h1H3
InChIKey ILOZXNRFCOMYNK-UHFFFAOYSA-N
Molecular Weight 213.113 g/mol
SMILES c1(C(N(=O)=O)(N(=O)=O)C#N)n[n](C)nn1
SPLASH splash10-01q9-9150000000-a6552431f4c8f7236d17
Source of Spectrum HC-49-716-1
Wiley ID 1739662