| SpectraBase Spectrum ID |
1pfApPiw8iI |
| Name |
[4,6-bis(2-methoxy-2-oxo-ethylidene)-2,5-diphenyl-1H-pyrimidin-5-yl] benzoate |
| Appearance |
Yellow amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
496.163436495 u |
| Formula |
C29H24N2O6 |
| InChI |
InChI=1S/C29H24N2O6/c1-35-25(32)18-23-29(22-16-10-5-11-17-22,37-28(34)21-14-8-4-9-15-21)24(19-26(33)36-2)31-27(30-23)20-12-6-3-7-13-20/h3-19H,1-2H3,(H,30,31) |
| InChIKey |
XGAUAYWTSZMWOB-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jo400090w |
| Molecular Weight |
496.519 g/mol |
| Quality |
124 |
| SMILES |
N1C(=NC(C(C1=CC(OC)=O)(C1=CC=CC=C1)OC(C1=CC=CC=C1)=O)=CC(OC)=O)C=1C=CC=CC1 |
| SPLASH |
splash10-0a4i-2409400000-4237eeaed7129ad15100 |
| Source of Spectrum |
JOC-78-3460-6aa (DOI: 10.1021/jo400090w) |
| Wiley ID |
1912495 |
![[4,6-bis(2-methoxy-2-oxo-ethylidene)-2,5-diphenyl-1H-pyrimidin-5-yl] benzoate](/api/spectrum/1pfApPiw8iI/structure.png?h=300&w=458 "[4,6-bis(2-methoxy-2-oxo-ethylidene)-2,5-diphenyl-1H-pyrimidin-5-yl] benzoate")
