SpectraBase Compound ID | FTqGTR1f6BT |
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InChI | InChI=1S/C8H15NO2/c1-3-11-8(10)7-4-5-9(2)6-7/h7H,3-6H2,1-2H3 |
InChIKey | DHWKOWPDAGMVOD-UHFFFAOYSA-N |
Mol Weight | 157.21 g/mol |
Molecular Formula | C8H15NO2 |
Exact Mass | 157.110279 g/mol |
SpectraBase Spectrum ID | 1poRYyMAdo8 |
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Name | Ethyl 1-methylpyrrolidine-3-carboxylate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 157.110278725 u |
Formula | C8H15NO2 |
InChI | InChI=1S/C8H15NO2/c1-3-11-8(10)7-4-5-9(2)6-7/h7H,3-6H2,1-2H3 |
InChIKey | DHWKOWPDAGMVOD-UHFFFAOYSA-N |
Molecular Weight | 157.213 g/mol |
SMILES | C1N(CCC1C(=O)OCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965765 |