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3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde
SpectraBase Compound ID GRgpZxBFplm
InChI InChI=1S/C14H16N2O/c1-11(2)8-14-12(10-17)9-16(15-14)13-6-4-3-5-7-13/h3-7,9-11H,8H2,1-2H3
InChIKey YTPBEOKDVWZQDB-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C14H16N2O
Exact Mass 228.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JB77TQD0Pnw
Name 3-Isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde
Alternate Name(s) 3-(2-Methylpropyl)-1-phenyl-4-pyrazolecarboxaldehyde 3-(2-Methylpropyl)-1-phenylpyrazole-4-carbaldehyde 3-(2-Methylpropyl)-1-phenyl-pyrazole-4-carbaldehyde
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Formula C14H16N2O
InChI InChI=1S/C14H16N2O/c1-11(2)8-14-12(10-17)9-16(15-14)13-6-4-3-5-7-13/h3-7,9-11H,8H2,1-2H3
InChIKey YTPBEOKDVWZQDB-UHFFFAOYSA-N
Molecular Weight 228.295 g/mol
SMILES c1[n](nc(c1C=O)CC(C)C)-c1ccccc1
SPLASH splash10-0a7l-3940000000-a5f6c1dd2f1a82914e1f
Source of Spectrum F2-46-233-3
Wiley ID 1689829