SpectraBase Spectrum ID |
3dR5Sdsp1u1 |
Name |
Poly(esterimide) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
632.179480481 u |
Formula |
C36H28N2O9 |
InChI |
InChI=1S/C36H28N2O9/c1-3-26(39)19-47-36(45)23-9-15-28-30(18-23)34(43)38(32(28)41)25-12-6-21(7-13-25)16-20-4-10-24(11-5-20)37-31(40)27-14-8-22(35(44)46-2)17-29(27)33(37)42/h4-15,17-18,26,39H,3,16,19H2,1-2H3 |
InChIKey |
YYPQIAJIBVYMRM-UHFFFAOYSA-N |
Molecular Weight |
632.625 g/mol |
Nominal Mass |
632 u |
SMILES |
C(C1=CC=C(N2C(C=3C=CC(C(OCC(CC)O)=O)=CC3C2=O)=O)C=C1)C=1C=CC(N2C(C3=C(C=C(C=C3)C(=O)OC)C2=O)=O)=CC1 |