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2-METHYL-5-OXO-1-PHENYLPYRAZOLE-4-ETHYLCARBOXYLATE
SpectraBase Compound ID 5XtM86YumQx
InChI InChI=1S/C13H14N2O3/c1-3-18-13(17)11-9-14(2)15(12(11)16)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey DCTSHNXJYZHQSG-UHFFFAOYSA-N
Mol Weight 246.27 g/mol
Molecular Formula C13H14N2O3
Exact Mass 246.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hG2tBaBVtP
Name 1-Methyl-3-oxo-2-phenyl-4-pyrazolecarboxylic acid ethyl ester
Alternate Name(s) 3-keto-1-methyl-2-phenyl-3-pyrazoline-4-carboxylic acid ethyl ester Ethyl 1-methyl-3-oxidanylidene-2-phenyl-pyrazole-4-carboxylate Ethyl 1-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate Ethyl 1-methyl-3-oxo-2-phenyl-pyrazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O3
InChI InChI=1S/C13H14N2O3/c1-3-18-13(17)11-9-14(2)15(12(11)16)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey DCTSHNXJYZHQSG-UHFFFAOYSA-N
Molecular Weight 246.266 g/mol
SMILES C=1(C(N(c2ccccc2)N(C1)C)=O)C(=O)OCC
SPLASH splash10-0fka-5980000000-8bb88f4a4e35194ded2c
Source of Spectrum Y-32-1348-9
Wiley ID 1248843