| SpectraBase Compound ID | BE4RXHFklUy |
|---|---|
| InChI | InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(27)25-14-9-13-15(30-3)10-24(32-5,17(14)19(13)28)18(22(25)26)20(31-4)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1 |
| InChIKey | DFEZSQMRHFPRME-NFRQMPIISA-N |
| Mol Weight | 451.6 g/mol |
| Molecular Formula | C25H41NO6 |
| Exact Mass | 451.293388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1RkdY3GGPyC |
|---|---|
| Name | 8-O-METHYL-1-EPI-NEOLINE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H41NO6 |
| InChI | InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(27)25-14-9-13-15(30-3)10-24(32-5,17(14)19(13)28)18(22(25)26)20(31-4)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1 |
| InChIKey | DFEZSQMRHFPRME-NFRQMPIISA-N |
| Literature Reference Author | S.W.PELLETIER,H.K.DESAI,Q.JIANG,S.A.ROSS |
| Literature Reference Citation | PHYTOCHEM.,29,3649(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85293-O |
| Molecular Weight | 451.604 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26941 |