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2-Dodecyl-1,2,4-triazole-3,5-dial
SpectraBase Compound ID 7aYQ45jMvWI
InChI InChI=1S/C16H27N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-19-16(14-21)17-15(13-20)18-19/h13-14H,2-12H2,1H3
InChIKey JBBSIRKVGGBTDL-UHFFFAOYSA-N
Mol Weight 293.41 g/mol
Molecular Formula C16H27N3O2
Exact Mass 293.210327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FjeU1fvp8fS
Name 2-Dodecyl-1,2,4-triazole-3,5-dial
Comments Less than 3 mono-isotopic peaks
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Formula C16H27N3O2
InChI InChI=1S/C16H27N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-19-16(14-21)17-15(13-20)18-19/h13-14H,2-12H2,1H3
InChIKey JBBSIRKVGGBTDL-UHFFFAOYSA-N
Molecular Weight 293.411 g/mol
SMILES c1(nc(n[n]1CCCCCCCCCCCC)C=O)C=O
SPLASH splash10-03di-0090000000-193bb3746d306458361a
Source of Spectrum AT-39-1069-5
Synonyms 1-dodecyl-1H-1,2,4-triazole-3,5-dicarbaldehyde
Wiley ID 854134