For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3-(4-Fluorophenyl)-5-methyl-4-(1-tosyl-pyrazol-3-yl)isoxazole

View entire compound with spectra: 1 NMR

3-(4-Fluorophenyl)-5-methyl-4-(1-tosyl-pyrazol-3-yl)isoxazole
SpectraBase Compound ID EfHkOibknOE
InChI InChI=1S/C20H16FN3O3S/c1-13-3-9-17(10-4-13)28(25,26)24-12-11-18(22-24)19-14(2)27-23-20(19)15-5-7-16(21)8-6-15/h3-12H,1-2H3
InChIKey HTPZGSABLDKTQO-UHFFFAOYSA-N
Mol Weight 397.42 g/mol
Molecular Formula C20H16FN3O3S
Exact Mass 397.089641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FBiImgCOr1r
Name 3-(4-Fluorophenyl)-5-methyl-4-(1-tosyl-pyrazol-3-yl)isoxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.089640721 u
Formula C20H16FN3O3S
InChI InChI=1S/C20H16FN3O3S/c1-13-3-9-17(10-4-13)28(25,26)24-12-11-18(22-24)19-14(2)27-23-20(19)15-5-7-16(21)8-6-15/h3-12H,1-2H3
InChIKey HTPZGSABLDKTQO-UHFFFAOYSA-N
Molecular Weight 397.424 g/mol
SMILES C1(=NOC(=C1C1=NN(C=C1)S(=O)(=O)C1=CC=C(C)C=C1)C)C1=CC=C(C=C1)F