| SpectraBase Compound ID | CtA6atrHHAe |
|---|---|
| InChI | InChI=1S/C13H21NO/c1-11(2)14-10-6-9-13(15)12-7-4-3-5-8-12/h3-5,7-8,11,13-15H,6,9-10H2,1-2H3 |
| InChIKey | IJVOHISVWWINNP-UHFFFAOYSA-N |
| Mol Weight | 207.32 g/mol |
| Molecular Formula | C13H21NO |
| Exact Mass | 207.162314 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GXiM7Z4Fx3A |
|---|---|
| Name | 1-Phenyl-4-(propan-2-ylamino)-1-butanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.162314299 u |
| Formula | C13H21NO |
| InChI | InChI=1S/C13H21NO/c1-11(2)14-10-6-9-13(15)12-7-4-3-5-8-12/h3-5,7-8,11,13-15H,6,9-10H2,1-2H3 |
| InChIKey | IJVOHISVWWINNP-UHFFFAOYSA-N |
| Molecular Weight | 207.317 g/mol |
| SMILES | C1(C(O)CCCNC(C)C)=CC=CC=C1 |