| SpectraBase Spectrum ID |
LeONf1B5UP8 |
| Name |
(+)-(1R,5S)-6-Benzyl-8-(4-methoxybenzyl)-6,8-diazabicyclo[3.2.2]non-3-en-2-one |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H24N2O2 |
| InChI |
InChI=1S/C22H24N2O2/c1-26-20-10-7-18(8-11-20)14-24-15-19-9-12-22(25)21(24)16-23(19)13-17-5-3-2-4-6-17/h2-12,19,21H,13-16H2,1H3/t19-,21+/m0/s1 |
| InChIKey |
KDGZBVMBOKHOME-PZJWPPBQSA-N |
| Instrument Name |
Thermo-Finnigan MAT GCQ |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm801522j |
| Molecular Weight |
348.446 g/mol |
| Optical Rotation |
[a]D20 = +71.4 (c = 0.19, CH2Cl2) |
| SMILES |
C1(C=C[C@@]2(N(C[C@]1(N(C2)Cc1ccc(cc1)OC)[H])Cc1ccccc1)[H])=O |
| SPLASH |
splash10-00di-3900000000-0843ede7192133000e17 |
| Source of Spectrum |
AF-52-SM42-28 |
| Thin-Layer Chromatography |
Rf = 0.28 (CH2Cl2/methanol, 100:1) |
| Wiley ID |
1873849 |
![(+)-(1R,5S)-6-Benzyl-8-(4-methoxybenzyl)-6,8-diazabicyclo[3.2.2]non-3-en-2-one](/api/spectrum/LeONf1B5UP8/structure.png?h=300&w=458 "(+)-(1R,5S)-6-Benzyl-8-(4-methoxybenzyl)-6,8-diazabicyclo[3.2.2]non-3-en-2-one")
