| SpectraBase Compound ID | FOpesTUyS80 |
|---|---|
| InChI | InChI=1S/C13H21N/c1-2-3-4-5-9-12-14-13-10-7-6-8-11-13/h6-8,10-11,14H,2-5,9,12H2,1H3 |
| InChIKey | JHXGAYWKTQKNGW-UHFFFAOYSA-N |
| Mol Weight | 191.32 g/mol |
| Molecular Formula | C13H21N |
| Exact Mass | 191.1674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G0LsVHbGNvB |
|---|---|
| Name | N-Heptylaniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.167399680 u |
| Formula | C13H21N |
| InChI | InChI=1S/C13H21N/c1-2-3-4-5-9-12-14-13-10-7-6-8-11-13/h6-8,10-11,14H,2-5,9,12H2,1H3 |
| InChIKey | JHXGAYWKTQKNGW-UHFFFAOYSA-N |
| Molecular Weight | 191.318 g/mol |
| SMILES | C=1(NCCCCCCC)C=CC=CC1 |