| SpectraBase Spectrum ID |
DTnLPNi23qb |
| Name |
2-Propenoic acid, 2-methyl-, carbonylbis(4,1-phenyleneoxycarbonylimino-2,1-ethanediyl) ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
524.179480481 u |
| Formula |
C27H28N2O9 |
| InChI |
InChI=1S/C27H28N2O9/c1-17(2)24(31)35-15-13-28-26(33)37-21-9-5-19(6-10-21)23(30)20-7-11-22(12-8-20)38-27(34)29-14-16-36-25(32)18(3)4/h5-12H,1,3,13-16H2,2,4H3,(H,28,33)(H,29,34) |
| InChIKey |
KRMQOFAWTHPCIK-UHFFFAOYSA-N |
| Molecular Weight |
524.526 g/mol |
| SMILES |
N(C(OC1=CC=C(C(C2=CC=C(OC(NCCOC(C(=C)C)=O)=O)C=C2)=O)C=C1)=O)CCOC(C(=C)C)=O |
