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Allyl 2-(1H-Tetrazol-5-yl)-2-cyanoacetate
SpectraBase Compound ID Gwmd5qQxYfh
InChI InChI=1S/C7H7N5O2/c1-2-3-14-7(13)5(4-8)6-9-11-12-10-6/h2,5H,1,3H2,(H,9,10,11,12)
InChIKey MJVIGHMBDKJTJC-UHFFFAOYSA-N
Mol Weight 193.17 g/mol
Molecular Formula C7H7N5O2
Exact Mass 193.059974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5w72F7I6X4A
Name Allyl 2-(1H-Tetrazol-5-yl)-2-cyanoacetate
Comments Less than 3 mono-isotopic peaks
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Formula C7H7N5O2
InChI InChI=1S/C7H7N5O2/c1-2-3-14-7(13)5(4-8)6-9-11-12-10-6/h2,5H,1,3H2,(H,9,10,11,12)
InChIKey MJVIGHMBDKJTJC-UHFFFAOYSA-N
Molecular Weight 193.166 g/mol
SMILES [nH]1c(nnn1)C(C(=O)OCC=C)C#N
SPLASH splash10-0006-9000000000-663ba6bbc05fb4a2797c
Source of Spectrum SO-0-874-3
Synonyms allyl cyano(1H-tetraazol-5-yl)acetate
Wiley ID 1544411