SpectraBase Spectrum ID |
3qNsZ165RNP |
Name |
1-(5,6-Diphenyl-1,2,4-triazin-3-yl)-4-[(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl) carbonyl]-1H-pyrazole |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H21N5O5 |
InChI |
InChI=1S/C29H21N5O5/c1-37-26-20-13-14-39-27(20)28(38-2)25(36)21(26)24(35)19-15-30-34(16-19)29-31-22(17-9-5-3-6-10-17)23(32-33-29)18-11-7-4-8-12-18/h3-16,36H,1-2H3 |
InChIKey |
OQJODJHQMHMBBF-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GC-2010 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jhet.2733 |
Molecular Weight |
519.517 g/mol |
SMILES |
Oc1c(C(c2cn[n](-c3nc(c(-c4ccccc4)nn3)-c3ccccc3)c2)=O)c(c2c(c1OC)occ2)OC |
SPLASH |
splash10-05i0-2690010000-ef2f70cf5140f35cff60 |
Source of Spectrum |
Y-54-1475-18 |
Wiley ID |
1878239 |