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4,4-Dimethyl-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1-penten-3-one
SpectraBase Compound ID CzLCOYQVAER
InChI InChI=1S/C13H20N2O/c1-9-11(10(2)15(6)14-9)7-8-12(16)13(3,4)5/h7-8H,1-6H3/b8-7+
InChIKey MIRFYIGEETVNMM-BQYQJAHWSA-N
Mol Weight 220.32 g/mol
Molecular Formula C13H20N2O
Exact Mass 220.157563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Y08FiwiZ1
Name 4,4-Dimethyl-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1-penten-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20N2O
InChI InChI=1S/C13H20N2O/c1-9-11(10(2)15(6)14-9)7-8-12(16)13(3,4)5/h7-8H,1-6H3/b8-7+
InChIKey MIRFYIGEETVNMM-BQYQJAHWSA-N
Molecular Weight 220.316 g/mol
SMILES c1(c([n](C)nc1C)C)\C=C\C(C(C)(C)C)=O
SPLASH splash10-03di-6900000000-e989f828aebb107fe837
Source of Spectrum AD-0-2532-0
Synonyms (E)-4,4-dimethyl-1-(1,3,5-trimethyl-4-pyrazolyl)-1-penten-3-one (E)-4,4-dimethyl-1-(1,3,5-trimethylpyrazol-4-yl)pent-1-en-3-one
Wiley ID 1435250