| SpectraBase Spectrum ID |
GX6bOIodVdz |
| Name |
N-benzyl-3-aza-5.alpha.-cholestane |
| Alternate Name(s) |
(4aR,4bS,6aR,7R,9aS,9bS,11aR)-2-benzyl-7-[(1R)-1,5-dimethylhexyl]-4a,6a-dimethylhexadecahydro-1H-indeno[5,4-f]isoquinoline |
| CAS Registry Number |
96034-25-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H53N |
| InChI |
InChI=1S/C33H53N/c1-24(2)10-9-11-25(3)29-16-17-30-28-15-14-27-23-34(22-26-12-7-6-8-13-26)21-20-32(27,4)31(28)18-19-33(29,30)5/h6-8,12-13,24-25,27-31H,9-11,14-23H2,1-5H3/t25-,27+,28+,29-,30+,31+,32+,33-/m1/s1 |
| InChIKey |
LZQIOHOJLXMIKH-IJXDZZBXSA-N |
| Molecular Weight |
463.794 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CCN(Cc2ccccc2)C4)C)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-03di-3000900000-fabfafe1e7564d5c0120 |
| Source of Spectrum |
J-55-2174-16 |
| Wiley ID |
1391350 |
