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2-Chloro-7-(4-methoxyphenyl)-5-oxo-3,5-dihydro[1,2,4]triazolo[1,5-a]pyridine-6,8-dicarbonitrile
SpectraBase Compound ID 3wlND6b2TUS
InChI InChI=1S/C15H8ClN5O2/c1-23-9-4-2-8(3-5-9)12-10(6-17)13-19-15(16)20-21(13)14(22)11(12)7-18/h2-5H,1H3,(H,19,20)
InChIKey BDWPSHNHCNDSLX-UHFFFAOYSA-N
Mol Weight 325.72 g/mol
Molecular Formula C15H8ClN5O2
Exact Mass 325.036652 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID erATP5JpQQ
Name 2-Chloro-7-(4-methoxyphenyl)-5-oxo-3,5-dihydro[1,2,4]triazolo[1,5-a]pyridine-6,8-dicarbonitrile
Appearance Deep yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H8ClN5O2
InChI InChI=1S/C15H8ClN5O2/c1-23-9-4-2-8(3-5-9)12-10(6-17)13-19-15(16)20-21(13)14(22)11(12)7-18/h2-5H,1H3,(H,19,20)
InChIKey BDWPSHNHCNDSLX-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2749
Molecular Weight 325.715 g/mol
SMILES N1C(=NC2=C(C(=C(C(N12)=O)C#N)c1ccc(cc1)OC)C#N)Cl
SPLASH splash10-0a4i-9473000000-d149fb5bdb60d26dc541
Source of Spectrum Y-54-1608-3
Wiley ID 1878316