![N-[2-Cyclododecylaminoethyl]aziridine](/api/spectrum/KuqmBmkQSFt/structure.png?h=300&w=458 "N-[2-Cyclododecylaminoethyl]aziridine")
| SpectraBase Compound ID | 5HSzCg7xOB2 |
|---|---|
| InChI | InChI=1S/C16H32N2/c1-2-4-6-8-10-16(11-9-7-5-3-1)17-12-13-18-14-15-18/h16-17H,1-15H2 |
| InChIKey | QTLMYCCPMUUIDE-UHFFFAOYSA-N |
| Mol Weight | 252.4 g/mol |
| Molecular Formula | C16H32N2 |
| Exact Mass | 252.256549 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KuqmBmkQSFt |
|---|---|
| Name | N-[2-Cyclododecylaminoethyl]aziridine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.256549038 u |
| Formula | C16H32N2 |
| InChI | InChI=1S/C16H32N2/c1-2-4-6-8-10-16(11-9-7-5-3-1)17-12-13-18-14-15-18/h16-17H,1-15H2 |
| InChIKey | QTLMYCCPMUUIDE-UHFFFAOYSA-N |
| Molecular Weight | 252.446 g/mol |
| SMILES | C1CCCCCCC(CCCC1)NCCN1CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940923 |