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6-[(1E,3E)-4-(2H-[1,2,3]triazol-4-yl)-1,3-butadienyl]-2-pyridylmethyl acetate
SpectraBase Compound ID Guc7vk9xSrr
InChI InChI=1S/C14H14N4O2/c1-11(19)20-10-14-8-4-7-12(16-14)5-2-3-6-13-9-15-18-17-13/h2-9H,10H2,1H3,(H,15,17,18)/b5-2+,6-3+
InChIKey QGCUNPYZJXHXRM-BUSIMMOISA-N
Mol Weight 270.29 g/mol
Molecular Formula C14H14N4O2
Exact Mass 270.111676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1C2DeQ3ghvq
Name 6-[(1E,3E)-4-(2H-[1,2,3]triazol-4-yl)-1,3-butadienyl]-2-pyridylmethyl acetate
Appearance White solid
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Exact Mass 270.111675705 u
Formula C14H14N4O2
InChI InChI=1S/C14H14N4O2/c1-11(19)20-10-14-8-4-7-12(16-14)5-2-3-6-13-9-15-18-17-13/h2-9H,10H2,1H3,(H,15,17,18)/b5-2+,6-3+
InChIKey QGCUNPYZJXHXRM-BUSIMMOISA-N
Instrument Name Fisons VG Autospec Trio 1000
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0003.613
Quality 190
SMILES N1N=C(C=N1)\C=C\C=C\C1=CC=CC(=N1)COC(C)=O
SPLASH splash10-00ba-0590000000-7d78d07ee6dd70bdf55f
Source of Spectrum ARK-2002-150-9a (DOI: 10.3998/ark.5550190.0003.613)
Wiley ID 1904722