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Ethanone, 1-(1H-pyrazol-4-yl)-
SpectraBase Compound ID 7AIIjTO9MdM
InChI InChI=1S/C5H6N2O/c1-4(8)5-2-6-7-3-5/h2-3H,1H3,(H,6,7)
InChIKey SSGVCJCDGSZFJI-UHFFFAOYSA-N
Mol Weight 110.12 g/mol
Molecular Formula C5H6N2O
Exact Mass 110.048013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KHWXStRws2K
Name Ethanone, 1-(1H-pyrazol-4-yl)-
CAS Registry Number 25016-16-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6N2O
InChI InChI=1S/C5H6N2O/c1-4(8)5-2-6-7-3-5/h2-3H,1H3,(H,6,7)
InChIKey SSGVCJCDGSZFJI-UHFFFAOYSA-N
Molecular Weight 110.116 g/mol
SMILES [nH]1ncc(c1)C(C)=O
SPLASH splash10-0002-9100000000-acfd7c94da19defbb89f
Source of Spectrum JZ-1992-605-0
Synonyms 1-(1H-Pyrazol-4-yl)ethanone 4-Acetylpyrazole Ketone, methyl pyrazol-4-yl
Wiley ID 1122272