| SpectraBase Compound ID | 5Crz4vZg5b7 |
|---|---|
| InChI | InChI=1S/C13H13N/c1-2-5-11-9-8-10-6-3-4-7-12(10)13(11)14/h2-4,6-9H,1,5,14H2 |
| InChIKey | CODXJJVDWAAGDM-UHFFFAOYSA-N |
| Mol Weight | 183.25 g/mol |
| Molecular Formula | C13H13N |
| Exact Mass | 183.104799 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4ZfiPiGAeL8 |
|---|---|
| Name | 2-Allylnaphthalen-1-amine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.104799423 u |
| Formula | C13H13N |
| InChI | InChI=1S/C13H13N/c1-2-5-11-9-8-10-6-3-4-7-12(10)13(11)14/h2-4,6-9H,1,5,14H2 |
| InChIKey | CODXJJVDWAAGDM-UHFFFAOYSA-N |
| Molecular Weight | 183.254 g/mol |
| SMILES | C=1C=C(C(N)=C2C1C=CC=C2)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961401 |