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5-(Pyrazol-5'-yl)-1-(phenyl)-3-methyl-4-formylpyrazole
SpectraBase Compound ID 2mHQpYzJMPE
InChI InChI=1S/C14H12N4O/c1-10-12(9-19)14(13-7-8-15-16-13)18(17-10)11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16)
InChIKey HWALHYOXJVLRSE-UHFFFAOYSA-N
Mol Weight 252.28 g/mol
Molecular Formula C14H12N4O
Exact Mass 252.101111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6B6C7Svr4Wh
Name 5-(Pyrazol-5'-yl)-1-(phenyl)-3-methyl-4-formylpyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4O
InChI InChI=1S/C14H12N4O/c1-10-12(9-19)14(13-7-8-15-16-13)18(17-10)11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16)
InChIKey HWALHYOXJVLRSE-UHFFFAOYSA-N
Molecular Weight 252.277 g/mol
SMILES [nH]1nccc1-c1[n](nc(C)c1C=O)-c1ccccc1
SPLASH splash10-052f-0590000000-f14bb26d02f61b189615
Source of Spectrum MZ-34-1547-16
Synonyms 3-Methyl-1-phenyl-5-(1H-pyrazol-5-yl)-1H-pyrazole-4-carbaldehyde 5-(Pyrazol-3'-yl)-1-phenyl-3-methyl-4-formylpyrazole
Wiley ID 1582248