Systematic / IUPAC Name: 4-[4-(4-Fluorophenoxy)-5-methyl-1H-pyrazol-3-yl]-1,3-benzenediol
ID: Reference4050
Other Names:
1,3-Benzenediol, 4-[4-(4-fluorophenoxy)-5-methyl-1H-pyrazol-3-yl]-;
4-[4-(4-Fluorophenoxy)-3-methyl-1H-pyrazol-5-yl]benzene-1,3-diol;
4-[4-(4-Fluorophenoxy)-5-methyl-1H-pyrazol-3-yl]benzene-1,3-diol;
4-[4-(4-Fluorophenoxy)-5-methylpyrazol-3-yl]benzene-1,3-diol
Formula: C16H13FN2O3
4-[4-(4-Fluorophenoxy)-5-methyl-1H-3-pyrazolyl]-1,3-benzenediol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 2 |
No. of Spectra | 234 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 3/3/2016 11:16:03 AM |
InChI | InChI=1S/C16H13FN2O3/c1-9-16(22-12-5-2-10(17)3-6-12)15(19-18-9)13-7-4-11(20)8-14(13)21/h2-8,20-21H,1H3,(H,18,19) |
InChI Key | GJKRGPNMAMNZDR-UHFFFAOYSA-N |
Canonical SMILES | Cc1c(c(n[nH]1)c2ccc(cc2O)O)Oc3ccc(cc3)F |
CAS | 297147956 |
Splash | |
Other Names |
1,3-Benzenediol, 4-[4-(4-fluorophenoxy)-5-methyl-1H-pyrazol-3-yl]-; 4-[4-(4-Fluorophenoxy)-3-methyl-1H-pyrazol-5-yl]benzene-1,3-diol; 4-[4-(4-Fluorophenoxy)-5-methyl-1H-pyrazol-3-yl]benzene-1,3-diol; 4-[4-(4-Fluorophenoxy)-5-methylpyrazol-3-yl]benzene-1,3-diol |
ChEMBL | CHEMBL187828 |
ChemSpider | 12995381 |