| SpectraBase Spectrum ID |
HzGSuQNkgH7 |
| Name |
(+)-(1R,4S)-11-Allyl-2-(4-methoxybenzyl)-1,2,3,4,5,10-hexahydro-4,1-iminomethanoazepino[3,4-b]indole |
| Appearance |
Pale-yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H27N3O |
| InChI |
InChI=1S/C24H27N3O/c1-3-12-26-16-23-24-21(20-6-4-5-7-22(20)25-24)13-18(26)15-27(23)14-17-8-10-19(28-2)11-9-17/h3-11,18,23,25H,1,12-16H2,2H3/t18-,23+/m0/s1 |
| InChIKey |
YXNBXEUSILNDFN-FDDCHVKYSA-N |
| Instrument Name |
Thermo-Finnigan MAT GCQ |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm801522j |
| Molecular Weight |
373.500 g/mol |
| Optical Rotation |
[a]D20 = +97.4 (c = 0.15, CH2Cl2) |
| SMILES |
[nH]1c2c(c3c1[C@]1(CN([C@@](C3)(CN1Cc1ccc(cc1)OC)[H])CC=C)[H])cccc2 |
| SPLASH |
splash10-00di-0913000000-3187e6525eed815f501f |
| Source of Spectrum |
AF-52-SM31-20a |
| Thin-Layer Chromatography |
Rf = 0.02 (CH2Cl2/methanol, 50:1) |
| Wiley ID |
1873842 |
![(+)-(1R,4S)-11-Allyl-2-(4-methoxybenzyl)-1,2,3,4,5,10-hexahydro-4,1-iminomethanoazepino[3,4-b]indole](/api/spectrum/HzGSuQNkgH7/structure.png?h=300&w=458 "(+)-(1R,4S)-11-Allyl-2-(4-methoxybenzyl)-1,2,3,4,5,10-hexahydro-4,1-iminomethanoazepino[3,4-b]indole")
