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1H-Pyrazole-4-carboxylic acid, 1,3-dimethyl-5-phenyl-, ethyl ester
SpectraBase Compound ID IshfeJ8vLku
InChI InChI=1S/C14H16N2O2/c1-4-18-14(17)12-10(2)15-16(3)13(12)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3
InChIKey XEWSVZCAYCGEBB-UHFFFAOYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C14H16N2O2
Exact Mass 244.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MSSlpJMZL3
Name 1H-Pyrazole-4-carboxylic acid, 1,3-dimethyl-5-phenyl-, ethyl ester
CAS Registry Number 77435-42-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O2
InChI InChI=1S/C14H16N2O2/c1-4-18-14(17)12-10(2)15-16(3)13(12)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3
InChIKey XEWSVZCAYCGEBB-UHFFFAOYSA-N
Molecular Weight 244.294 g/mol
SMILES c1(c([n](C)nc1C)-c1ccccc1)C(=O)OCC
SPLASH splash10-0005-4940000000-7cb375676597829d206c
Source of Spectrum KC-1981-645-0
Synonyms 1,3-Dimethyl-5-phenyl-4-pyrazolecarboxylic acid ethyl ester 1,3-Dimethyl-5-phenyl-pyrazole-4-carboxylic acid ethyl ester Ethyl 1,3-dimethyl-5-phenyl-1H-pyrazole-4-carboxylate Ethyl 1,3-dimethyl-5-phenyl-pyrazole-4-carboxylate
Wiley ID 1247131