| SpectraBase Spectrum ID |
50YD0V4tQcJ |
| Name |
1,1'-(Methylenedi-p-phenylene)bis[3,3-dipropylurea] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
452.315126542 u |
| Formula |
C27H40N4O2 |
| InChI |
InChI=1S/C27H40N4O2/c1-5-17-30(18-6-2)26(32)28-24-13-9-22(10-14-24)21-23-11-15-25(16-12-23)29-27(33)31(19-7-3)20-8-4/h9-16H,5-8,17-21H2,1-4H3,(H,28,32)(H,29,33) |
| InChIKey |
YFUXBUHMBVFCFE-UHFFFAOYSA-N |
| Molecular Weight |
452.643 g/mol |
| SMILES |
N(C1=CC=C(CC=2C=CC(=CC2)NC(N(CCC)CCC)=O)C=C1)C(N(CCC)CCC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.773234 |
![1,1'-(Methylenedi-p-phenylene)bis[3,3-dipropylurea]](/api/spectrum/50YD0V4tQcJ/structure.png?h=300&w=458 "1,1'-(Methylenedi-p-phenylene)bis[3,3-dipropylurea]")
