| SpectraBase Compound ID | GAUnj6pu5SL |
|---|---|
| InChI | InChI=1S/C12H20N2/c1-3-12(13,10-14-2)9-11-7-5-4-6-8-11/h4-8,14H,3,9-10,13H2,1-2H3 |
| InChIKey | PVQWQFNEYKSHOA-UHFFFAOYSA-N |
| Mol Weight | 192.31 g/mol |
| Molecular Formula | C12H20N2 |
| Exact Mass | 192.162649 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HhydMCT1Wxw |
|---|---|
| Name | 2-Benzyl-N(1)-methylbutane-1,2-diamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.162648652 u |
| Formula | C12H20N2 |
| InChI | InChI=1S/C12H20N2/c1-3-12(13,10-14-2)9-11-7-5-4-6-8-11/h4-8,14H,3,9-10,13H2,1-2H3 |
| InChIKey | PVQWQFNEYKSHOA-UHFFFAOYSA-N |
| Molecular Weight | 192.306 g/mol |
| SMILES | C(CC=1C=CC=CC1)(N)(CNC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.910853 |