| SpectraBase Compound ID | 7BuZC3ct87O |
|---|---|
| InChI | InChI=1S/C13H21NO/c1-3-4-5-13(15-2)10-11-6-8-12(14)9-7-11/h6-9,13H,3-5,10,14H2,1-2H3 |
| InChIKey | BXLQQWDSBPKJHC-UHFFFAOYSA-N |
| Mol Weight | 207.32 g/mol |
| Molecular Formula | C13H21NO |
| Exact Mass | 207.162314 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4fYLcWJNdNx |
|---|---|
| Name | 4-(2-Methoxyhexyl)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.162314299 u |
| Formula | C13H21NO |
| InChI | InChI=1S/C13H21NO/c1-3-4-5-13(15-2)10-11-6-8-12(14)9-7-11/h6-9,13H,3-5,10,14H2,1-2H3 |
| InChIKey | BXLQQWDSBPKJHC-UHFFFAOYSA-N |
| Molecular Weight | 207.317 g/mol |
| SMILES | C=1(N)C=CC(=CC1)CC(CCCC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.842016 |