| SpectraBase Compound ID | 4zkEaRkn5f9 |
|---|---|
| InChI | InChI=1S/C16H23NO2/c1-14-8-4-5-9-16(14)19-13-15(18-2)12-17-10-6-3-7-11-17/h3-6,8-9,15H,7,10-13H2,1-2H3 |
| InChIKey | IYBDYEMMGHIOQW-UHFFFAOYSA-N |
| Mol Weight | 261.36 g/mol |
| Molecular Formula | C16H23NO2 |
| Exact Mass | 261.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bt5Zvlmlpz6 |
|---|---|
| Name | 1-(3,6-Dihydro-1(2H)-pyridinyl)-3-(2-methylphenoxy)-2-propanol, methyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.172878983 u |
| Formula | C16H23NO2 |
| InChI | InChI=1S/C16H23NO2/c1-14-8-4-5-9-16(14)19-13-15(18-2)12-17-10-6-3-7-11-17/h3-6,8-9,15H,7,10-13H2,1-2H3 |
| InChIKey | IYBDYEMMGHIOQW-UHFFFAOYSA-N |
| Molecular Weight | 261.365 g/mol |
| SMILES | C(OC1=C(C)C=CC=C1)C(CN1CCC=CC1)OC |