SpectraBase Compound ID | 1laB86y75KZ |
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InChI | InChI=1S/C6H12N2O/c7-3-5-8-4-1-2-6(8)9/h1-5,7H2 |
InChIKey | HHEKNWQXFVOUNJ-UHFFFAOYSA-N |
Mol Weight | 128.17 g/mol |
Molecular Formula | C6H12N2O |
Exact Mass | 128.094963 g/mol |
SpectraBase Spectrum ID | AjkV4qu3zLI |
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Name | 2-Pyrrolidinone, 1-(2-aminoethyl)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 128.094963013 u |
Formula | C6H12N2O |
InChI | InChI=1S/C6H12N2O/c7-3-5-8-4-1-2-6(8)9/h1-5,7H2 |
InChIKey | HHEKNWQXFVOUNJ-UHFFFAOYSA-N |
Molecular Weight | 128.175 g/mol |
SMILES | C1CC(=O)N(C1)CCN |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966502 |