SpectraBase Spectrum ID |
1i9qajinExq |
Name |
Poly{[3,7-dihydroxy-5-(p-chlorophenyl)-1,9-dioxa-5-azanonamethylene-1,4-phenylene-isopropylidene-1,4-phenylene]-co-[3,7-dihydroxy-5-(p-methoxyphenyl)-1,9-dioxa-5-azanonamethylene-1,4-phenylene-isopropylidene-1,4-phenylene]} |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
990.516109694 u |
Formula |
C59H75ClN2O9 |
InChI |
InChI=1S/C30H39NO5.C29H36ClNO4/c1-22-6-8-23(9-7-22)30(2,3)24-10-14-29(15-11-24)36-21-27(33)19-31(18-26(32)20-34-4)25-12-16-28(35-5)17-13-25;1-21-5-7-22(8-6-21)29(2,3)23-9-15-28(16-10-23)35-20-27(33)18-31(17-26(32)19-34-4)25-13-11-24(30)12-14-25/h6-17,26-27,32-33H,18-21H2,1-5H3;5-16,26-27,32-33H,17-20H2,1-4H3 |
InChIKey |
KHMXNMGQNZXNAK-UHFFFAOYSA-N |
Molecular Weight |
991.707 g/mol |
Nominal Mass |
990 u |
SMILES |
C(OC)C(O)CN(C1=CC=C(C=C1)Cl)CC(O)COC1=CC=C(C=C1)C(C)(C)C=1C=CC(=CC1)C.C(OC)C(O)CN(C1=CC=C(C=C1)OC)CC(O)COC1=CC=C(C=C1)C(C)(C)C=1C=CC(=CC1)C |