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3-Methyl-1-phenyl-1H-pyrazol-5-yl benzoate

View entire compound with spectra: 2 NMR, and 1 MS (GC)

3-Methyl-1-phenyl-1H-pyrazol-5-yl benzoate
SpectraBase Compound ID KWdGAwquv34
InChI InChI=1S/C17H14N2O2/c1-13-12-16(19(18-13)15-10-6-3-7-11-15)21-17(20)14-8-4-2-5-9-14/h2-12H,1H3
InChIKey YVVNCZNGWZHOGZ-UHFFFAOYSA-N
Mol Weight 278.31 g/mol
Molecular Formula C17H14N2O2
Exact Mass 278.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hww6TGTcs9L
Name 3-Methyl-1-phenyl-1H-pyrazol-5-yl benzoate
CAS Registry Number 56159-67-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O2
InChI InChI=1S/C17H14N2O2/c1-13-12-16(19(18-13)15-10-6-3-7-11-15)21-17(20)14-8-4-2-5-9-14/h2-12H,1H3
InChIKey YVVNCZNGWZHOGZ-UHFFFAOYSA-N
Molecular Weight 278.311 g/mol
SMILES Cc1n[n](c(c1)OC(=O)c1ccccc1)-c1ccccc1
SPLASH splash10-0a4i-6900000000-58b1eff453556e5cd306
Synonyms (5-methyl-2-phenyl-pyrazol-3-yl) benzoate benzoic acid (5-methyl-2-phenyl-3-pyrazolyl) ester benzoic acid (5-methyl-2-phenyl-pyrazol-3-yl) ester Benzoic acid 5-methyl-2-phenyl-2H-pyrazol-3-yl ester
Wiley ID 1458490