| SpectraBase Compound ID | IqMECeOhEn5 |
|---|---|
| InChI | InChI=1S/C23H26N2O5/c1-28-16-8-14-15(9-17(16)29-2)24-20(26)10-18-21-13-7-19-23(14,22(21)24)4-5-25(19,27)11-12(13)3-6-30-18/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3/t13?,18?,19?,21?,22?,23-,25?/m1/s1 |
| InChIKey | HHHQMKWPZAYIAE-OPENZBRPSA-N |
| Mol Weight | 410.47 g/mol |
| Molecular Formula | C23H26N2O5 |
| Exact Mass | 410.184172 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | wRcP3nAyt5 |
|---|---|
| Name | BRUCINE-N-OXIDE |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H26N2O5 |
| InChI | InChI=1S/C23H26N2O5/c1-28-16-8-14-15(9-17(16)29-2)24-20(26)10-18-21-13-7-19-23(14,22(21)24)4-5-25(19,27)11-12(13)3-6-30-18/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3/t13?,18?,19?,21?,22?,23-,25?/m1/s1 |
| InChIKey | HHHQMKWPZAYIAE-OPENZBRPSA-N |
| Literature Reference Author | C.E.HADDEN,B.D.KALUZNY,R.H.ROBINS,G.E.MARTIN |
| Literature Reference Citation | MAGN.RES.CHEM.,37,325(1999) |
| Literature Reference DOI | 10.1002/(sici)1097-458x(199904)37:4<325::aid-mrc453>3.3.co;2-5 |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS23776 |