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3-(3-n-Butyl-5-phenyl-1H-pyrazol-1-yl)butanoic acid

View entire compound with spectra: 1 MS (GC)

3-(3-n-Butyl-5-phenyl-1H-pyrazol-1-yl)butanoic acid
SpectraBase Compound ID DvuYoPv4Eie
InChI InChI=1S/C17H22N2O2/c1-3-4-10-15-12-16(14-8-6-5-7-9-14)19(18-15)13(2)11-17(20)21/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,20,21)
InChIKey PVDXFUFEXPOEQS-UHFFFAOYSA-N
Mol Weight 286.37 g/mol
Molecular Formula C17H22N2O2
Exact Mass 286.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4G4gRkAmdU
Name 3-(3-n-Butyl-5-phenyl-1H-pyrazol-1-yl)butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O2
InChI InChI=1S/C17H22N2O2/c1-3-4-10-15-12-16(14-8-6-5-7-9-14)19(18-15)13(2)11-17(20)21/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,20,21)
InChIKey PVDXFUFEXPOEQS-UHFFFAOYSA-N
Molecular Weight 286.375 g/mol
SMILES OC(CC([n]1c(cc(n1)CCCC)-c1ccccc1)C)=O
SPLASH splash10-0a4l-0960000000-4b4c7404a8760533a2af
Source of Spectrum J-73-8067-61
Wiley ID 1668697