| SpectraBase Compound ID | JJvIsFDRoyR |
|---|---|
| InChI | InChI=1S/C7H18N2/c1-7(2,5-8-3)6-9-4/h8-9H,5-6H2,1-4H3 |
| InChIKey | JXRIGNBVDJINOQ-UHFFFAOYSA-N |
| Mol Weight | 130.23 g/mol |
| Molecular Formula | C7H18N2 |
| Exact Mass | 130.146999 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7SdMyyLB7nT |
|---|---|
| Name | 1,3-Propanediamine, N,N',2,2-tetramethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.146998588 u |
| Formula | C7H18N2 |
| InChI | InChI=1S/C7H18N2/c1-7(2,5-8-3)6-9-4/h8-9H,5-6H2,1-4H3 |
| InChIKey | JXRIGNBVDJINOQ-UHFFFAOYSA-N |
| Molecular Weight | 130.235 g/mol |
| SMILES | CNCC(C)(C)CNC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930833 |