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5-Chloro-1-(1,1-dimethylethyl)-3-(2-pyridyl)-1H-pyrazole-4-carbaldehyde
SpectraBase Compound ID Dt6pdbuda3h
InChI InChI=1S/C13H14ClN3O/c1-13(2,3)17-12(14)9(8-18)11(16-17)10-6-4-5-7-15-10/h4-8H,1-3H3
InChIKey ZKHNPPWKOBYJBC-UHFFFAOYSA-N
Mol Weight 263.73 g/mol
Molecular Formula C13H14ClN3O
Exact Mass 263.08254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OGjczlLhJP
Name 5-Chloro-1-(1,1-dimethylethyl)-3-(2-pyridyl)-1H-pyrazole-4-carbaldehyde
Appearance Pale yellow solid
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Formula C13H14ClN3O
InChI InChI=1S/C13H14ClN3O/c1-13(2,3)17-12(14)9(8-18)11(16-17)10-6-4-5-7-15-10/h4-8H,1-3H3
InChIKey ZKHNPPWKOBYJBC-UHFFFAOYSA-N
Instrument Name Shimadzu GP 1000
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.188
Molecular Weight 263.728 g/mol
Reported Formula C13H14ClN3O
SMILES c1(Cl)c(c(n[n]1C(C)(C)C)-c1ncccc1)C=O
SPLASH splash10-004i-1920000000-e1a9386462b16aec4a24
Source of Spectrum ARK-2014-144-4c
Wiley ID 1843210