| SpectraBase Spectrum ID |
JIiflI64zBP |
| Name |
6-(6-(2-Methoxy-2-oxoethyl)-2,5-diphenylpyrimidin-4-yl)methyl Benzoate |
| Appearance |
Yellowish amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
438.157957192 u |
| Formula |
C27H22N2O4 |
| InChI |
InChI=1S/C27H22N2O4/c1-32-24(30)17-22-25(19-11-5-2-6-12-19)23(18-33-27(31)21-15-9-4-10-16-21)29-26(28-22)20-13-7-3-8-14-20/h2-16H,17-18H2,1H3 |
| InChIKey |
DGKVXVDNBUUCOM-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jo400090w |
| Molecular Weight |
438.483 g/mol |
| Quality |
104 |
| Reported Formula |
C27H22N2O4 |
| SMILES |
C1(=C(C(=NC(=N1)C1=CC=CC=C1)CC(OC)=O)C1=CC=CC=C1)COC(C1=CC=CC=C1)=O |
| SPLASH |
splash10-001i-2409200000-ba0180b60ee9374ec5bf |
| Source of Spectrum |
JOC-78-3461-10aa (DOI: 10.1021/jo400090w) |
| Wiley ID |
1912481 |
