| SpectraBase Compound ID | 9i4zJ9GqHrw |
|---|---|
| InChI | InChI=1S/C8H15N/c1-8(2,3)7-5-4-6-9-7/h5,9H,4,6H2,1-3H3 |
| InChIKey | YPNGFYOHBPYEKZ-UHFFFAOYSA-N |
| Mol Weight | 125.21 g/mol |
| Molecular Formula | C8H15N |
| Exact Mass | 125.120449 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1NVvSjBBbiX |
|---|---|
| Name | 2-Tert-butyl-pyrroline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 125.120449487 u |
| Formula | C8H15N |
| InChI | InChI=1S/C8H15N/c1-8(2,3)7-5-4-6-9-7/h5,9H,4,6H2,1-3H3 |
| InChIKey | YPNGFYOHBPYEKZ-UHFFFAOYSA-N |
| Molecular Weight | 125.215 g/mol |
| SMILES | C=1(NCCC1)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974548 |