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Benzoic acid, 4-(4-bromo-1H-pyrazol-1-yl)-, (2,4-dichlorophenyl)methyl ester
SpectraBase Compound ID EyVFOwnMz1O
InChI InChI=1S/C17H11BrCl2N2O2/c18-13-8-21-22(9-13)15-5-2-11(3-6-15)17(23)24-10-12-1-4-14(19)7-16(12)20/h1-9H,10H2
InChIKey LFAYWYRWJAVCNN-UHFFFAOYSA-N
Mol Weight 426.1 g/mol
Molecular Formula C17H11BrCl2N2O2
Exact Mass 423.938096 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BptMI5kxmX3
Name Benzoic acid, 4-(4-bromo-1H-pyrazol-1-yl)-, (2,4-dichlorophenyl)methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11BrCl2N2O2
InChI InChI=1S/C17H11BrCl2N2O2/c18-13-8-21-22(9-13)15-5-2-11(3-6-15)17(23)24-10-12-1-4-14(19)7-16(12)20/h1-9H,10H2
InChIKey LFAYWYRWJAVCNN-UHFFFAOYSA-N
Molecular Weight 426.097 g/mol
SMILES c1(ccc(C(=O)OCc2ccc(cc2Cl)Cl)cc1)-[n]1cc(cn1)Br
SPLASH splash10-116s-2982300000-427322b474488124ad64
Source of Spectrum IY-1-4625-3
Synonyms 4-(4-bromo-1-pyrazolyl)benzoic acid (2,4-dichlorophenyl)methyl ester (2,4-dichlorophenyl)methyl 4-(4-bromopyrazol-1-yl)benzoate (2,4-dichlorophenyl)methyl 4-(4-bromanylpyrazol-1-yl)benzoate
Wiley ID 1654236