SpectraBase Spectrum ID |
7WXRTZOlViI |
Name |
(-)-(1S,5S,Z)-6-Allyl-2-benzylidene-8-(4-methoxybenzyl)-6,8-diazabicyclo[3.2.2]nonane |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H30N2O |
InChI |
InChI=1S/C25H30N2O/c1-3-15-26-19-25-22(16-20-7-5-4-6-8-20)11-12-23(26)18-27(25)17-21-9-13-24(28-2)14-10-21/h3-10,13-14,16,23,25H,1,11-12,15,17-19H2,2H3/b22-16-/t23-,25+/m0/s1 |
InChIKey |
DMIJLPDYIZRQGT-SUVUEDDMSA-N |
Instrument Name |
Thermo-Finnigan MAT GCQ |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jm801522j |
Molecular Weight |
374.528 g/mol |
Optical Rotation |
[a]D20 = -82.9 (c = 0.73, CH2Cl2) |
SMILES |
C1\C([C@]2(CN([C@@](C1)(CN2Cc1ccc(cc1)OC)[H])CC=C)[H])=C\c1ccccc1 |
SPLASH |
splash10-00di-0927000000-caef0731e4a177ca04d7 |
Source of Spectrum |
AF-52-SM25-17a |
Thin-Layer Chromatography |
Rf = 0.07 (CH2Cl2/methanol, 50:1) |
Wiley ID |
1873840 |