| SpectraBase Compound ID | 5JBTFk7mSfY |
|---|---|
| InChI | InChI=1S/C12H18N2/c13-8-4-5-9-14-10-12(14)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,13H2 |
| InChIKey | ZALLYDBAZWIIPK-UHFFFAOYSA-N |
| Mol Weight | 190.29 g/mol |
| Molecular Formula | C12H18N2 |
| Exact Mass | 190.146999 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2KugQ3tBIv0 |
|---|---|
| Name | 4-(2-Phenyl-1-aziridinyl)butylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.146998588 u |
| Formula | C12H18N2 |
| InChI | InChI=1S/C12H18N2/c13-8-4-5-9-14-10-12(14)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,13H2 |
| InChIKey | ZALLYDBAZWIIPK-UHFFFAOYSA-N |
| Molecular Weight | 190.290 g/mol |
| SMILES | C1(N(C1)CCCCN)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935004 |