| SpectraBase Compound ID | 9u8OuNZmBoL |
|---|---|
| InChI | InChI=1S/C10H22N4O2/c11-9(15)13-7-5-3-1-2-4-6-8-14-10(12)16/h1-8H2,(H3,11,13,15)(H3,12,14,16) |
| InChIKey | RHLMRYXDLQYJQC-UHFFFAOYSA-N |
| Mol Weight | 230.31 g/mol |
| Molecular Formula | C10H22N4O2 |
| Exact Mass | 230.174276 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Ig9ESXWZmCB |
|---|---|
| Name | 1,1'-Octamethylenediurea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.174275962 u |
| Formula | C10H22N4O2 |
| InChI | InChI=1S/C10H22N4O2/c11-9(15)13-7-5-3-1-2-4-6-8-14-10(12)16/h1-8H2,(H3,11,13,15)(H3,12,14,16) |
| InChIKey | RHLMRYXDLQYJQC-UHFFFAOYSA-N |
| Molecular Weight | 230.312 g/mol |
| SMILES | NC(=O)NCCCCCCCCNC(=O)N |
| Spectrum/Structure Validation Score (Raman) | 0.807059 |