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Ethyl 1-(anilinocarbonyl)-3-methyl-4,5-dihydro-1H-pyrazole-5-carboxylate
SpectraBase Compound ID 8tnSuDnnmV
InChI InChI=1S/C14H17N3O3/c1-3-20-13(18)12-9-10(2)16-17(12)14(19)15-11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3,(H,15,19)
InChIKey FQINCMQFPVJEJY-UHFFFAOYSA-N
Mol Weight 275.31 g/mol
Molecular Formula C14H17N3O3
Exact Mass 275.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bsSaQPSkK
Name Ethyl 1-(anilinocarbonyl)-3-methyl-4,5-dihydro-1H-pyrazole-5-carboxylate
Alternate Name(s) Ethyl 3-methyl-1-(phenylcarbamoyl)-4,5-dihydro-1H-pyrazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N3O3
InChI InChI=1S/C14H17N3O3/c1-3-20-13(18)12-9-10(2)16-17(12)14(19)15-11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3,(H,15,19)
InChIKey FQINCMQFPVJEJY-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo5016097
Molecular Weight 275.308 g/mol
SMILES N(C(N1C(C(=O)OCC)CC(=N1)C)=O)c1ccccc1
SPLASH splash10-05r0-0960000000-c1db8105ce245f6627de
Source of Spectrum J-79-8335-3k
Wiley ID 1748170