| SpectraBase Spectrum ID |
48r2jTS9Vi9 |
| Name |
1-o-Tert-butyl 3-o-methyl 3-methylpyrrolidine-1,3-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
243.147058156 u |
| Formula |
C12H21NO4 |
| InChI |
InChI=1S/C12H21NO4/c1-11(2,3)17-10(15)13-7-6-12(4,8-13)9(14)16-5/h6-8H2,1-5H3 |
| InChIKey |
AUABPENEDJXJQH-UHFFFAOYSA-N |
| Molecular Weight |
243.303 g/mol |
| SMILES |
C1(CN(C(OC(C)(C)C)=O)CC1)(C(=O)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943711 |
