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Ethyl 2-(1H-Tetrazol-5-yl)-2-cyanoacetate
SpectraBase Compound ID Gj00hadbBOT
InChI InChI=1S/C6H7N5O2/c1-2-13-6(12)4(3-7)5-8-10-11-9-5/h4H,2H2,1H3,(H,8,9,10,11)
InChIKey MHYQORCNIOAJJI-UHFFFAOYSA-N
Mol Weight 181.16 g/mol
Molecular Formula C6H7N5O2
Exact Mass 181.059974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BoZv4T8NOMg
Name Ethyl 2-(1H-Tetrazol-5-yl)-2-cyanoacetate
Comments Less than 3 mono-isotopic peaks
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Formula C6H7N5O2
InChI InChI=1S/C6H7N5O2/c1-2-13-6(12)4(3-7)5-8-10-11-9-5/h4H,2H2,1H3,(H,8,9,10,11)
InChIKey MHYQORCNIOAJJI-UHFFFAOYSA-N
Molecular Weight 181.155 g/mol
SMILES [nH]1c(nnn1)C(C(=O)OCC)C#N
SPLASH splash10-001i-9100000000-7e6cee6b5014dd00832f
Source of Spectrum SO-0-874-3
Synonyms ethyl cyano(1H-tetraazol-5-yl)acetate
Wiley ID 1544416