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1-(1-phenyl-1H-pyrazol-4-yl)ethan-1-one
SpectraBase Compound ID KPNwcFECpAT
InChI InChI=1S/C11H10N2O/c1-9(14)10-7-12-13(8-10)11-5-3-2-4-6-11/h2-8H,1H3
InChIKey ZZLLGMSBHKIMHK-UHFFFAOYSA-N
Mol Weight 186.21 g/mol
Molecular Formula C11H10N2O
Exact Mass 186.079313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXXMhPiiWEb
Name 1-(1-phenyl-1H-pyrazol-4-yl)ethan-1-one
Appearance Faint yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2O
InChI InChI=1S/C11H10N2O/c1-9(14)10-7-12-13(8-10)11-5-3-2-4-6-11/h2-8H,1H3
InChIKey ZZLLGMSBHKIMHK-UHFFFAOYSA-N
Instrument Name Thermo GCMS DFS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2673
Molecular Weight 186.214 g/mol
SMILES c1(ccccc1)-[n]1ncc(c1)C(C)=O
SPLASH splash10-00di-1900000000-9c4d545d508157a353bc
Source of Spectrum Y-54-1052-23
Wiley ID 1878055