| SpectraBase Compound ID | 5fMG4se6bm8 |
|---|---|
| InChI | InChI=1S/C19H27NO2/c1-20-11-10-19-9-5-4-6-14(19)15(20)12-13-7-8-16(21-2)18(22-3)17(13)19/h7-8,14-15H,4-6,9-12H2,1-3H3/t14?,15-,19-/m1/s1 |
| InChIKey | LSGUAQWHSBQIKX-PQYJZYHDSA-N |
| Mol Weight | 301.43 g/mol |
| Molecular Formula | C19H27NO2 |
| Exact Mass | 301.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B079e4Xl2cK |
|---|---|
| Name | Morphinan, 3,4-dimethoxy-N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.204179111 u |
| Formula | C19H27NO2 |
| InChI | InChI=1S/C19H27NO2/c1-20-11-10-19-9-5-4-6-14(19)15(20)12-13-7-8-16(21-2)18(22-3)17(13)19/h7-8,14-15H,4-6,9-12H2,1-3H3/t14?,15-,19-/m1/s1 |
| InChIKey | LSGUAQWHSBQIKX-PQYJZYHDSA-N |
| SMILES | C12CCCC[C@]22C3=C(C[C@]1(N(C)CC2)[H])C=CC(=C3OC)OC |