| SpectraBase Compound ID | 2KJCJX7Mzar |
|---|---|
| InChI | InChI=1S/C6H16N2/c1-2-5-8-6-3-4-7/h8H,2-7H2,1H3 |
| InChIKey | OWKYZAGJTTTXOK-UHFFFAOYSA-N |
| Mol Weight | 116.21 g/mol |
| Molecular Formula | C6H16N2 |
| Exact Mass | 116.131349 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IKEYQDoorAb |
|---|---|
| Name | N-Propyl-1,3-propanediamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 116.131348523 u |
| Formula | C6H16N2 |
| InChI | InChI=1S/C6H16N2/c1-2-5-8-6-3-4-7/h8H,2-7H2,1H3 |
| InChIKey | OWKYZAGJTTTXOK-UHFFFAOYSA-N |
| Molecular Weight | 116.208 g/mol |
| SMILES | NCCCNCCC |
| Spectrum/Structure Validation Score (Raman) | 0.966556 |