SpectraBase Spectrum ID |
AbzaJsVEsb3 |
Name |
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-tris[2-[2-(methoxycarbonyl)phenylmethoxy]ethyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
705.253373696 u |
Formula |
C36H39N3O12 |
InChI |
InChI=1S/C36H39N3O12/c1-46-31(40)28-13-7-4-10-25(28)22-49-19-16-37-34(43)38(17-20-50-23-26-11-5-8-14-29(26)32(41)47-2)36(45)39(35(37)44)18-21-51-24-27-12-6-9-15-30(27)33(42)48-3/h4-15H,16-24H2,1-3H3 |
InChIKey |
IFEMCYNFLHKSAL-UHFFFAOYSA-N |
Molecular Weight |
705.717 g/mol |
SMILES |
C1(N(C(N(C(N1CCOCC1=CC=CC=C1C(OC)=O)=O)CCOCC1=CC=CC=C1C(OC)=O)=O)CCOCC1=CC=CC=C1C(OC)=O)=O |