![2,5-Diisopropyl-7-azabicyclo[2.2.1]heptane](/api/spectrum/6WLmUkA9V75/structure.png?h=300&w=458 "2,5-Diisopropyl-7-azabicyclo[2.2.1]heptane")
| SpectraBase Compound ID | Cqw5wYFDwiG |
|---|---|
| InChI | InChI=1S/C12H23N/c1-7(2)9-5-12-10(8(3)4)6-11(9)13-12/h7-13H,5-6H2,1-4H3 |
| InChIKey | UHAVXXVDHVWPIJ-UHFFFAOYSA-N |
| Mol Weight | 181.32 g/mol |
| Molecular Formula | C12H23N |
| Exact Mass | 181.18305 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6WLmUkA9V75 |
|---|---|
| Name | 2,5-Diisopropyl-7-azabicyclo[2.2.1]heptane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.183049745 u |
| Formula | C12H23N |
| InChI | InChI=1S/C12H23N/c1-7(2)9-5-12-10(8(3)4)6-11(9)13-12/h7-13H,5-6H2,1-4H3 |
| InChIKey | UHAVXXVDHVWPIJ-UHFFFAOYSA-N |
| Molecular Weight | 181.323 g/mol |
| SMILES | C12NC(CC2C(C)C)C(C(C)C)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.918982 |