| SpectraBase Compound ID | DV78vYdDbsu |
|---|---|
| InChI | InChI=1S/C20H21NO4/c1-21-7-6-11-8-16-20(25-10-24-16)18-12-4-5-15(22-2)19(23-3)13(12)9-14(21)17(11)18/h4-5,8,14H,6-7,9-10H2,1-3H3 |
| InChIKey | UVDQDNQWGQFIAO-UHFFFAOYSA-N |
| Mol Weight | 339.39 g/mol |
| Molecular Formula | C20H21NO4 |
| Exact Mass | 339.147058 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6WrYyzLsS0e |
|---|---|
| Name | Crebanine |
| Alternate Name(s) | 5H-benzo(g)-1,3-benzodioxolo(6,5,4-de)quinoline, 6,7,7a,8-tetrahydro-9,10-dimethoxy-7-methyl-, (R)- 8,9-Dimethoxy-1,2-(methylenedioxy)aporphine 9,10-dimethoxy-7-methyl-6,7,7a,8-tetrahydro-5H-[1,3]benzodioxolo[6,5,4-de]benzo[g]quinoline Aporphine, 8,9-dimethoxy-1,2-(methylenedioxy)- Crebanin |
| CAS Registry Number | 25127-29-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H21NO4 |
| InChI | InChI=1S/C20H21NO4/c1-21-7-6-11-8-16-20(25-10-24-16)18-12-4-5-15(22-2)19(23-3)13(12)9-14(21)17(11)18/h4-5,8,14H,6-7,9-10H2,1-3H3 |
| InChIKey | UVDQDNQWGQFIAO-UHFFFAOYSA-N |
| Molecular Weight | 339.391 g/mol |
| SMILES | c12c3-c4ccc(c(c4CC2N(C)CCc1cc1OCOc31)OC)OC |
| SPLASH | splash10-000i-0019000000-c3dfb1aa6dd85aed8950 |
| Source of Spectrum | X2-46-765-38 |
| Wiley ID | 1601293 |