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2,3-DIMETHYL-3-PYRAZOLIN-5-ONE
SpectraBase Compound ID gmpHzx5oOO
InChI InChI=1S/C5H8N2O/c1-4-3-5(8)6-7(4)2/h3H,1-2H3,(H,6,8)
InChIKey ZITWSNQLWBKRBT-UHFFFAOYSA-N
Mol Weight 112.13 g/mol
Molecular Formula C5H8N2O
Exact Mass 112.063663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jym14THQ9X
Name 1,5-Dimethyl-1,2-dihydro-3H-pyrazol-3-one
Alternate Name(s) 1,5-Dimethyl-3-pyrazolin-3-one 2,3-Dimethyl-1H-pyrazol-5-one 2,3-Dimethyl-3-pyrazolin-5-one
CAS Registry Number 3201-28-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8N2O
InChI InChI=1S/C5H8N2O/c1-4-3-5(8)6-7(4)2/h3H,1-2H3,(H,6,8)
InChIKey ZITWSNQLWBKRBT-UHFFFAOYSA-N
Molecular Weight 112.132 g/mol
SMILES N1C(C=C(N1C)C)=O
SPLASH splash10-03di-9600000000-6fff5aba2d0e7738bd26
Wiley ID 1458611