| SpectraBase Compound ID | GUCfXCfmdWW |
|---|---|
| InChI | InChI=1S/C10H21NO/c1-10(2,3)9(12)8-11-6-4-5-7-11/h9,12H,4-8H2,1-3H3 |
| InChIKey | YGCSCXDFYNEGKS-UHFFFAOYSA-N |
| Mol Weight | 171.28 g/mol |
| Molecular Formula | C10H21NO |
| Exact Mass | 171.162314 g/mol |
| SpectraBase Spectrum ID | GjqZAChu8et |
|---|---|
| Name | Butan-2-ol, 3,3-dimethyl-1-(pyrrolidin-1-yl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.162314299 u |
| Formula | C10H21NO |
| InChI | InChI=1S/C10H21NO/c1-10(2,3)9(12)8-11-6-4-5-7-11/h9,12H,4-8H2,1-3H3 |
| InChIKey | YGCSCXDFYNEGKS-UHFFFAOYSA-N |
| Molecular Weight | 171.284 g/mol |
| SMILES | C1CN(CC(O)C(C)(C)C)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941727 |