| SpectraBase Compound ID | D8AudSYBN5D |
|---|---|
| InChI | InChI=1S/C8H18N4O2/c9-7(13)11-5-3-1-2-4-6-12-8(10)14/h1-6H2,(H3,9,11,13)(H3,10,12,14) |
| InChIKey | OJLHBQIGOFOFJF-UHFFFAOYSA-N |
| Mol Weight | 202.26 g/mol |
| Molecular Formula | C8H18N4O2 |
| Exact Mass | 202.142976 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3tfJiDNzfda |
|---|---|
| Name | 1,1'-Hexamethylenediurea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.142975834 u |
| Formula | C8H18N4O2 |
| InChI | InChI=1S/C8H18N4O2/c9-7(13)11-5-3-1-2-4-6-12-8(10)14/h1-6H2,(H3,9,11,13)(H3,10,12,14) |
| InChIKey | OJLHBQIGOFOFJF-UHFFFAOYSA-N |
| Molecular Weight | 202.258 g/mol |
| SMILES | N(C(N)=O)CCCCCCNC(N)=O |
| Spectrum/Structure Validation Score (Raman) | 0.920413 |