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2,4-Dihydro-5-methyl-2-phenyl-4-propionyl-3H-pyrazol-3-one
SpectraBase Compound ID 7Vjvw0Hzjxc
InChI InChI=1S/C13H14N2O2/c1-3-11(16)12-9(2)14-15(13(12)17)10-7-5-4-6-8-10/h4-8,12H,3H2,1-2H3
InChIKey HFGTVPSCLRKMJX-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C13H14N2O2
Exact Mass 230.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yPMu8HjkEC
Name 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(1-oxopropyl)-2-phenyl-
Alternate Name(s) 5-Methyl-2-phenyl-4-propionyl-2,4-dihydro-3H-pyrazol-3-one 2-Pyrazolin-5-one, 3-methyl-1-phenyl-4-propionyl- 5-Methyl-2-phenyl-4-propanoyl-4H-pyrazol-3-one 5-Methyl-2-phenyl-4-propionyl-2-pyrazolin-3-one 5-Methyl-4-(1-oxopropyl)-2-phenyl-4H-pyrazol-3-one
CAS Registry Number 31197-09-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O2
InChI InChI=1S/C13H14N2O2/c1-3-11(16)12-9(2)14-15(13(12)17)10-7-5-4-6-8-10/h4-8,12H,3H2,1-2H3
InChIKey HFGTVPSCLRKMJX-UHFFFAOYSA-N
Molecular Weight 230.267 g/mol
SMILES c1ccc(cc1)N1C(C(C(C)=N1)C(CC)=O)=O
SPLASH splash10-0udi-4190000000-9d357c95020e0e3da290
Source of Spectrum EP-6160-0-0
Wiley ID 1231794