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

*Links on SpectraBase are not permalinks.
4-[1-(4-Chlorophenyl)-4-(4-fluoirophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-3-(4-methoxyphenyl)sydnon
SpectraBase Compound ID 87UVQzQpgWA
InChI InChI=1S/C23H15ClFN5O4/c1-33-19-12-10-17(11-13-19)29-20(22(31)34-27-29)21-26-30(18-6-2-14(24)3-7-18)23(32)28(21)16-8-4-15(25)5-9-16/h2-13H,1H3
InChIKey SJUBRZMLAAVWKJ-UHFFFAOYSA-N
Mol Weight 479.86 g/mol
Molecular Formula C23H15ClFN5O4
Exact Mass 479.07966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Kp2RYcEv4hL
Name 4-[1-(4-Chlorophenyl)-4-(4-fluoirophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-3-(4-methoxyphenyl)sydnon
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H15ClFN5O4
InChI InChI=1S/C23H15ClFN5O4/c1-33-19-12-10-17(11-13-19)29-20(22(31)34-27-29)21-26-30(18-6-2-14(24)3-7-18)23(32)28(21)16-8-4-15(25)5-9-16/h2-13H,1H3
InChIKey SJUBRZMLAAVWKJ-UHFFFAOYSA-N
Molecular Weight 479.855 g/mol
SMILES C=1(N(C(=O)N(N1)c1ccc(cc1)Cl)c1ccc(cc1)F)c1[n+](noc1[O-])-c1ccc(cc1)OC
SPLASH splash10-00di-0000900000-dd5cc58604e528d58136
Source of Spectrum QA-47-238-11
Wiley ID 863382