| SpectraBase Compound ID | B6r2hxWdHgz |
|---|---|
| InChI | InChI=1S/C12H17N/c1-4-12(3,5-2)13-11-9-7-6-8-10-11/h4,6-10,13H,1,5H2,2-3H3 |
| InChIKey | OATUPDIKAYUINI-UHFFFAOYSA-N |
| Mol Weight | 175.27 g/mol |
| Molecular Formula | C12H17N |
| Exact Mass | 175.1361 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9RySzQGKQV7 |
|---|---|
| Name | N-(2-Ethyl-but-3-en-2-yl)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.136099551 u |
| Formula | C12H17N |
| InChI | InChI=1S/C12H17N/c1-4-12(3,5-2)13-11-9-7-6-8-10-11/h4,6-10,13H,1,5H2,2-3H3 |
| InChIKey | OATUPDIKAYUINI-UHFFFAOYSA-N |
| Molecular Weight | 175.275 g/mol |
| SMILES | C(NC1=CC=CC=C1)(C=C)(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9219 |