![(1rs,2rs,1'sr)-2-[(Dimethylamino)(4-methoxyphenyl)methyl]cyclohexanol](/api/spectrum/HwaGBzvWNRE/structure.png?h=300&w=458 "(1rs,2rs,1'sr)-2-[(Dimethylamino)(4-methoxyphenyl)methyl]cyclohexanol")
| SpectraBase Compound ID | JNPAJXELvAb |
|---|---|
| InChI | InChI=1S/C16H25NO2/c1-17(2)16(14-6-4-5-7-15(14)18)12-8-10-13(19-3)11-9-12/h8-11,14-16,18H,4-7H2,1-3H3 |
| InChIKey | DNYJYZDVHVKHFL-UHFFFAOYSA-N |
| Mol Weight | 263.38 g/mol |
| Molecular Formula | C16H25NO2 |
| Exact Mass | 263.188529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HwaGBzvWNRE |
|---|---|
| Name | (1rs,2rs,1'sr)-2-[(Dimethylamino)(4-methoxyphenyl)methyl]cyclohexanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.188529047 u |
| Formula | C16H25NO2 |
| InChI | InChI=1S/C16H25NO2/c1-17(2)16(14-6-4-5-7-15(14)18)12-8-10-13(19-3)11-9-12/h8-11,14-16,18H,4-7H2,1-3H3 |
| InChIKey | DNYJYZDVHVKHFL-UHFFFAOYSA-N |
| Molecular Weight | 263.381 g/mol |
| SMILES | C1(C(C=2C=CC(=CC2)OC)N(C)C)C(O)CCCC1 |