SpectraBase Compound ID | LWUqOUXXYEh |
---|---|
InChI | InChI=1S/C16H32N2O/c17-13-9-7-5-3-1-2-4-6-8-10-14-18-15-11-12-16(18)19/h1-15,17H2 |
InChIKey | AWDGGAOYFMTHKT-UHFFFAOYSA-N |
Mol Weight | 268.4 g/mol |
Molecular Formula | C16H32N2O |
Exact Mass | 268.251464 g/mol |
SpectraBase Spectrum ID | IE0UYrWV5Vo |
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Name | N-(12-Aminododecyl)-2-pyrrolidone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 268.251463657 u |
Formula | C16H32N2O |
InChI | InChI=1S/C16H32N2O/c17-13-9-7-5-3-1-2-4-6-8-10-14-18-15-11-12-16(18)19/h1-15,17H2 |
InChIKey | AWDGGAOYFMTHKT-UHFFFAOYSA-N |
Molecular Weight | 268.445 g/mol |
SMILES | C1(N(CCC1)CCCCCCCCCCCCN)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953619 |