SpectraBase Compound ID | KjQhUBwldkb |
---|---|
InChI | InChI=1S/C23H26N2O4.2H2O/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18;;/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;2*1H2/t13-,18-,19-,21-,22-,23+;;/m0../s1 |
InChIKey | VWLBJWIPYIYRBM-FIMIILAWSA-N |
Mol Weight | 430.501 g/mol |
Molecular Formula | C23H30N2O6 |
Exact Mass | 430.210387 g/mol |
SpectraBase Spectrum ID | DO5RESvxKMS |
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Name | brucine, dihydrate |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C23H30N2O6 |
InChI | InChI=1S/C23H26N2O4.2H2O/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18;;/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;2*1H2/t13-,18-,19-,21-,22-,23+;;/m0../s1 |
InChIKey | VWLBJWIPYIYRBM-FIMIILAWSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 45555M |
Solvent | Polysol-d |