| SpectraBase Spectrum ID |
3woumgzqIXC |
| Name |
N,N'-(Pentamethylenebis(oxy-p-phenylenetrimethylene))diacetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
454.283157708 u |
| Formula |
C27H38N2O4 |
| InChI |
InChI=1S/C27H38N2O4/c1-22(30)28-18-6-8-24-10-14-26(15-11-24)32-20-4-3-5-21-33-27-16-12-25(13-17-27)9-7-19-29-23(2)31/h10-17H,3-9,18-21H2,1-2H3,(H,28,30)(H,29,31) |
| InChIKey |
UNJGGMQATWMZHQ-UHFFFAOYSA-N |
| Molecular Weight |
454.611 g/mol |
| SMILES |
C1=C(C=CC(=C1)OCCCCCOC1=CC=C(C=C1)CCCNC(C)=O)CCCNC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905799 |
