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Benzoic acid, 4-(1H-pyrazol-1-yl)-, (2-fluorophenyl)methyl ester
SpectraBase Compound ID 6gQ797XW1jP
InChI InChI=1S/C17H13FN2O2/c18-16-5-2-1-4-14(16)12-22-17(21)13-6-8-15(9-7-13)20-11-3-10-19-20/h1-11H,12H2
InChIKey RRTXRUQNUFKHAM-UHFFFAOYSA-N
Mol Weight 296.3 g/mol
Molecular Formula C17H13FN2O2
Exact Mass 296.096106 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5bLeNF4TK4w
Name Benzoic acid, 4-(1H-pyrazol-1-yl)-, (2-fluorophenyl)methyl ester
Alternate Name(s) 4-(1-pyrazolyl)benzoic acid (2-fluorophenyl)methyl ester (2-fluorophenyl)methyl 4-pyrazol-1-ylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13FN2O2
InChI InChI=1S/C17H13FN2O2/c18-16-5-2-1-4-14(16)12-22-17(21)13-6-8-15(9-7-13)20-11-3-10-19-20/h1-11H,12H2
InChIKey RRTXRUQNUFKHAM-UHFFFAOYSA-N
Molecular Weight 296.301 g/mol
SMILES c1(-[n]2nccc2)ccc(C(=O)OCc2ccccc2F)cc1
SPLASH splash10-0ab9-4920000000-e41dfe389c5235685916
Source of Spectrum IY-2-4846-8
Wiley ID 1656691