SpectraBase Spectrum ID |
EfU9MsRxr3 |
Name |
(+)-(1R,2R,5S)-6-Allyl-2-benzyloxy-8-(2,4-dimethoxybenzyl)-6,8-diazabicyclo[3.2.2]nonane |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H34N2O3 |
InChI |
InChI=1S/C26H34N2O3/c1-4-14-27-18-24-25(31-19-20-8-6-5-7-9-20)13-11-22(27)17-28(24)16-21-10-12-23(29-2)15-26(21)30-3/h4-10,12,15,22,24-25H,1,11,13-14,16-19H2,2-3H3/t22-,24+,25+/m0/s1 |
InChIKey |
PZPJWFZSIFACIE-ICDZXHCJSA-N |
Instrument Name |
Thermo-Finnigan MAT GCQ |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jm801522j |
Molecular Weight |
422.569 g/mol |
Optical Rotation |
[a]D = +19.2 (c = 0.29, CH2Cl2) |
SMILES |
c1cccc(CO[C@@]2(CC[C@@]3(N(C[C@]2(N(C3)Cc2ccc(cc2OC)OC)[H])CC=C)[H])[H])c1 |
SPLASH |
splash10-0uk9-2920500000-28d02f7032d8cddf3de7 |
Source of Spectrum |
AF-52-SM9-8b |
Thin-Layer Chromatography |
Rf = 0.02 (CH2Cl2/methanol, 50:1) |
Wiley ID |
1873856 |