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1-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methyl-1-propanone
SpectraBase Compound ID 6kWcOxuj6mf
InChI InChI=1S/C9H14N2O/c1-5(2)9(12)8-6(3)10-11-7(8)4/h5H,1-4H3,(H,10,11)
InChIKey SNOAIAFVKYDABL-UHFFFAOYSA-N
Mol Weight 166.22 g/mol
Molecular Formula C9H14N2O
Exact Mass 166.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZO7iYdq4nQ
Name 1-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methyl-1-propanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2O
InChI InChI=1S/C9H14N2O/c1-5(2)9(12)8-6(3)10-11-7(8)4/h5H,1-4H3,(H,10,11)
InChIKey SNOAIAFVKYDABL-UHFFFAOYSA-N
Molecular Weight 166.224 g/mol
SMILES [nH]1nc(c(c1C)C(=O)C(C)C)C
SPLASH splash10-00di-0900000000-3b5da96212e4da9137bd
Source of Spectrum Y-38-121-5
Synonyms 1-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methyl-propan-1-one
Wiley ID 848166