| SpectraBase Compound ID | Kx3qnkEu1a4 |
|---|---|
| InChI | InChI=1S/C12H19N/c1-3-8-11(4-2)13-12-9-6-5-7-10-12/h5-7,9-11,13H,3-4,8H2,1-2H3 |
| InChIKey | YJLVORCAELYSKX-UHFFFAOYSA-N |
| Mol Weight | 177.29 g/mol |
| Molecular Formula | C12H19N |
| Exact Mass | 177.15175 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9AH4qiAE2ii |
|---|---|
| Name | N-(3'-Hexyl)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.151749616 u |
| Formula | C12H19N |
| InChI | InChI=1S/C12H19N/c1-3-8-11(4-2)13-12-9-6-5-7-10-12/h5-7,9-11,13H,3-4,8H2,1-2H3 |
| InChIKey | YJLVORCAELYSKX-UHFFFAOYSA-N |
| Molecular Weight | 177.291 g/mol |
| SMILES | C1(NC(CC)CCC)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.819743 |