| SpectraBase Compound ID | 2Ix6btZ83XI |
|---|---|
| InChI | InChI=1S/C13H17N/c1-2-3-4-7-11-10-14-13-9-6-5-8-12(11)13/h5-6,8-10,14H,2-4,7H2,1H3 |
| InChIKey | AEBFIMYRMPFLOZ-UHFFFAOYSA-N |
| Mol Weight | 187.29 g/mol |
| Molecular Formula | C13H17N |
| Exact Mass | 187.1361 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HRvhfSGG8Xr |
|---|---|
| Name | 3-Pentylindole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.136099551 u |
| Formula | C13H17N |
| InChI | InChI=1S/C13H17N/c1-2-3-4-7-11-10-14-13-9-6-5-8-12(11)13/h5-6,8-10,14H,2-4,7H2,1H3 |
| InChIKey | AEBFIMYRMPFLOZ-UHFFFAOYSA-N |
| Molecular Weight | 187.286 g/mol |
| SMILES | C=12C(NC=C2CCCCC)=CC=CC1 |