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2-Benzoyl-3-methyl-3,4-dihydro-2H-pyrazole-3-carboxylic acid methyl ester
SpectraBase Compound ID DufbUlUz8K7
InChI InChI=1S/C13H14N2O3/c1-13(12(17)18-2)8-9-14-15(13)11(16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey KLMQYKLYORJUFE-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 CSKCfVhNL6H
Name 2-Benzoyl-3-methyl-3,4-dihydro-2H-pyrazole-3-carboxylic acid methyl ester
Alternate Name(s) 2-Benzoyl-3-methyl-4H-pyrazole-3-carboxylic acid methyl ester Methyl 2-benzoyl-3-methyl-4H-pyrazole-3-carboxylate Methyl 3-methyl-2-(phenylcarbonyl)-4H-pyrazole-3-carboxylate
CAS Registry Number 1258975-52-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O3
InChI InChI=1S/C13H14N2O3/c1-13(12(17)18-2)8-9-14-15(13)11(16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey KLMQYKLYORJUFE-UHFFFAOYSA-N
Molecular Weight 246.266 g/mol
SMILES C1(N(N=CC1)C(=O)c1ccccc1)(C(=O)OC)C
SPLASH splash10-0a4i-4900000000-a0d7d9e569c20b9968d8
Source of Spectrum F-66-9156-3e
Wiley ID 1685031