| SpectraBase Compound ID | 22fvSwLqDNV |
|---|---|
| InChI | InChI=1S/C19H29NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-6,12-14,18,21H,7-11H2,1-4H3 |
| InChIKey | FMTVBXORMSFNHS-UHFFFAOYSA-N |
| Mol Weight | 287.45 g/mol |
| Molecular Formula | C19H29NO |
| Exact Mass | 287.224915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2u8OTEx6SGR |
|---|---|
| Name | Dihydropentazocine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.224914557 u |
| Formula | C19H29NO |
| InChI | InChI=1S/C19H29NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-6,12-14,18,21H,7-11H2,1-4H3 |
| InChIKey | FMTVBXORMSFNHS-UHFFFAOYSA-N |
| Molecular Weight | 287.447 g/mol |
| SMILES | Oc1ccc2c(c1)C1(CCN(C(C2)C1C)CCC(C)C)C |