| SpectraBase Compound ID | 6rcLHSW06t8 |
|---|---|
| InChI | InChI=1S/C13H17N/c1-10-6-2-3-7-11(10)12-8-4-5-9-13(12)14/h4-5,8-9H,2-3,6-7,14H2,1H3 |
| InChIKey | XTDGTQTYUIODKW-UHFFFAOYSA-N |
| Mol Weight | 187.29 g/mol |
| Molecular Formula | C13H17N |
| Exact Mass | 187.1361 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4LJwJ3D7xxl |
|---|---|
| Name | 2-(2-Methylcyclohex-1-enyl)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.136099551 u |
| Formula | C13H17N |
| InChI | InChI=1S/C13H17N/c1-10-6-2-3-7-11(10)12-8-4-5-9-13(12)14/h4-5,8-9H,2-3,6-7,14H2,1H3 |
| InChIKey | XTDGTQTYUIODKW-UHFFFAOYSA-N |
| Molecular Weight | 187.286 g/mol |
| SMILES | C1(C=2C(N)=CC=CC2)=C(C)CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981979 |