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{6-[(1E,3E)-4-(5-Methyl-2H-[1,2,3]triazol-4-yl)-1,3-butadienyl]-2-pyridyl}-1-ethanone
SpectraBase Compound ID 4FB2LyvbUSF
InChI InChI=1S/C14H14N4O/c1-10-13(17-18-16-10)8-4-3-6-12-7-5-9-14(15-12)11(2)19/h3-9H,1-2H3,(H,16,17,18)/b6-3+,8-4+
InChIKey PQRLPMIWRJNPCU-PHQNLGIASA-N
Mol Weight 254.29 g/mol
Molecular Formula C14H14N4O
Exact Mass 254.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9gUNxI8bsTZ
Name {6-[(1E,3E)-4-(5-Methyl-2H-[1,2,3]triazol-4-yl)-1,3-butadienyl]-2-pyridyl}-1-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.116761086 u
Formula C14H14N4O
InChI InChI=1S/C14H14N4O/c1-10-13(17-18-16-10)8-4-3-6-12-7-5-9-14(15-12)11(2)19/h3-9H,1-2H3,(H,16,17,18)/b6-3+,8-4+
InChIKey PQRLPMIWRJNPCU-PHQNLGIASA-N
Instrument Name Fisons VG Autospec Trio 1000
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0003.613
Molecular Weight 254.293 g/mol
Quality 225
SMILES N1N=C(C(=N1)\C=C\C=C\C1=CC=CC(=N1)C(C)=O)C
SPLASH splash10-0ik9-0290000000-3908ab79a432177f12b2
Source of Spectrum ARK-2002-151-10b (DOI: 10.3998/ark.5550190.0003.613)
Wiley ID 1904717