| SpectraBase Spectrum ID |
BZYeEaQFWWM |
| Name |
(-)-(1'R,2'S,5'S)-6'-Allyl-8'-(4-methoxybenzyl)-3,4-dihydrospiro[2-benzopyran-1,2'6',8'-diazabicyclo[3.2.2]nonane] |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H32N2O2 |
| InChI |
InChI=1S/C26H32N2O2/c1-3-15-27-19-25-26(24-7-5-4-6-21(24)13-16-30-26)14-12-22(27)18-28(25)17-20-8-10-23(29-2)11-9-20/h3-11,22,25H,1,12-19H2,2H3/t22-,25+,26-/m0/s1 |
| InChIKey |
JISKHGXJHWBZCR-DFCKQENNSA-N |
| Instrument Name |
Thermo-Finnigan MAT GCQ |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm801522j |
| Molecular Weight |
404.554 g/mol |
| Optical Rotation |
[a]D20 = -38.2 (c = 0.05, CH2Cl2) |
| SMILES |
[C@]12(CC[C@@]3(N(C[C@]2(N(C3)Cc2ccc(cc2)OC)[H])CC=C)[H])OCCc2c1cccc2 |
| SPLASH |
splash10-0ul0-0851900000-8ddf726c67663c38e2e5 |
| Source of Spectrum |
AF-52-SM41-25 |
| Thin-Layer Chromatography |
Rf = 0.12 (CH2Cl2/methanol, 9.5:0.5) |
| Wiley ID |
1873848 |
![(-)-(1'R,2'S,5'S)-6'-Allyl-8'-(4-methoxybenzyl)-3,4-dihydrospiro[2-benzopyran-1,2'6',8'-diazabicyclo[3.2.2]nonane]](/api/spectrum/BZYeEaQFWWM/structure.png?h=300&w=458 "(-)-(1'R,2'S,5'S)-6'-Allyl-8'-(4-methoxybenzyl)-3,4-dihydrospiro[2-benzopyran-1,2'6',8'-diazabicyclo[3.2.2]nonane]")
