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4-(2-(phenylcarbonyloxy)-1-oxopropyl)-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one
SpectraBase Compound ID Ke1LJTxnkLa
InChI InChI=1S/C21H20N2O4/c1-14-18(20(25)23(22(14)3)17-12-8-5-9-13-17)19(24)15(2)27-21(26)16-10-6-4-7-11-16/h4-13,15H,1-3H3
InChIKey UFVYKMYJCYQHAT-UHFFFAOYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C21H20N2O4
Exact Mass 364.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZvUOkvB4gZ
Name 4-(2-(phenylcarbonyloxy)-1-oxopropyl)-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4
InChI InChI=1S/C21H20N2O4/c1-14-18(20(25)23(22(14)3)17-12-8-5-9-13-17)19(24)15(2)27-21(26)16-10-6-4-7-11-16/h4-13,15H,1-3H3
InChIKey UFVYKMYJCYQHAT-UHFFFAOYSA-N
Molecular Weight 364.401 g/mol
SMILES C=1(C(N(c2ccccc2)N(C1C)C)=O)C(C(OC(=O)c1ccccc1)C)=O
SPLASH splash10-066r-2190000000-78df539e6480b4df09ac
Source of Spectrum EMC-35-363-5b
Synonyms 1-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-oxopropan-2-yl benzoate Benzoic acid [1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-oxopropan-2-yl] ester [1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-oxopropan-2-yl] benzoate [2-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-methyl-2-oxo-ethyl] benzoate [1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-oxidanylidene-propan-2-yl] benzoate
Wiley ID 1734618