| SpectraBase Spectrum ID |
8r5Fein113N |
| Name |
5-Bromo-1-hydroxy-methyl-3-methyl-9-exo-hydroxy-9-[2-(3-methoxy-2-isopropoxy)phenyl-Z-ethenyl]-3-azabicyclo[3.3.1]nonane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32BrNO4 |
| InChI |
InChI=1S/C22H32BrNO4/c1-16(2)28-19-17(7-5-8-18(19)27-4)9-12-22(26)20(15-25)10-6-11-21(22,23)14-24(3)13-20/h5,7-9,12,16,25-26H,6,10-11,13-15H2,1-4H3/b12-9-/t20-,21-,22+/m0/s1 |
| InChIKey |
QKPSBPLXTUOGFU-XCKGUOBPSA-N |
| Molecular Weight |
454.405 g/mol |
| SMILES |
O[C@@]1([C@@]2(CO)CCC[C@]1(Br)CN(C2)C)\C=C/c1c(OC(C)C)c(OC)ccc1 |
| SPLASH |
splash10-0229-0509100000-db82ddd5c97763838b04 |
| Source of Spectrum |
KC-61-3765-20 |
| Synonyms |
1-Bromo-5-(hydroxymethyl)-9-[(Z)-2-(2-isopropoxy-3-methoxyphenyl)ethenyl]-3-methyl-3-azabicyclo[3.3.1]nonan-9-ol |
| Wiley ID |
1628587 |
![5-Bromo-1-hydroxy-methyl-3-methyl-9-exo-hydroxy-9-[2-(3-methoxy-2-isopropoxy)phenyl-Z-ethenyl]-3-azabicyclo[3.3.1]nonane](/api/spectrum/8r5Fein113N/structure.png?h=300&w=458 "5-Bromo-1-hydroxy-methyl-3-methyl-9-exo-hydroxy-9-[2-(3-methoxy-2-isopropoxy)phenyl-Z-ethenyl]-3-azabicyclo[3.3.1]nonane")
