![1-(2-Benzoxyethyl)-3-[6-(2-benzoxyethylcarbamoylamino)hexyl]urea](/api/spectrum/FZiPqQau6HV/structure.png?h=300&w=458 "1-(2-Benzoxyethyl)-3-[6-(2-benzoxyethylcarbamoylamino)hexyl]urea")
| SpectraBase Compound ID | 6Ca8EYQHUWP |
|---|---|
| InChI | InChI=1S/C26H38N4O4/c31-25(29-17-19-33-21-23-11-5-3-6-12-23)27-15-9-1-2-10-16-28-26(32)30-18-20-34-22-24-13-7-4-8-14-24/h3-8,11-14H,1-2,9-10,15-22H2,(H2,27,29,31)(H2,28,30,32) |
| InChIKey | JTUSCAQFBINSDK-UHFFFAOYSA-N |
| Mol Weight | 470.6 g/mol |
| Molecular Formula | C26H38N4O4 |
| Exact Mass | 470.289306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FZiPqQau6HV |
|---|---|
| Name | 1-(2-Benzoxyethyl)-3-[6-(2-benzoxyethylcarbamoylamino)hexyl]urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 470.289305716 u |
| Formula | C26H38N4O4 |
| InChI | InChI=1S/C26H38N4O4/c31-25(29-17-19-33-21-23-11-5-3-6-12-23)27-15-9-1-2-10-16-28-26(32)30-18-20-34-22-24-13-7-4-8-14-24/h3-8,11-14H,1-2,9-10,15-22H2,(H2,27,29,31)(H2,28,30,32) |
| InChIKey | JTUSCAQFBINSDK-UHFFFAOYSA-N |
| Molecular Weight | 470.614 g/mol |
| SMILES | C(=O)(NCCOCC=1C=CC=CC1)NCCCCCCNC(=O)NCCOCC=1C=CC=CC1 |