| SpectraBase Compound ID | 91KWwQzLJDF |
|---|---|
| InChI | InChI=1S/C6H9N3/c7-3-1-5-9-6-2-4-8/h9H,1-2,5-6H2 |
| InChIKey | SBAJRGRUGUQKAF-UHFFFAOYSA-N |
| Mol Weight | 123.16 g/mol |
| Molecular Formula | C6H9N3 |
| Exact Mass | 123.079647 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 9gbjBGgt09B |
|---|---|
| Name | 3,3'-Iminodipropionitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 123.079647302 u |
| Formula | C6H9N3 |
| InChI | InChI=1S/C6H9N3/c7-3-1-5-9-6-2-4-8/h9H,1-2,5-6H2 |
| InChIKey | SBAJRGRUGUQKAF-UHFFFAOYSA-N |
| Molecular Weight | 123.159 g/mol |
| SMILES | N(CCC#N)CCC#N |
| Spectrum/Structure Validation Score (Raman) | 0.973532 |