| SpectraBase Spectrum ID |
6wlqDUeXGaz |
| Name |
1H-5,8a-Propanoquinoline-2,7(3H,8H)-dione, 8-(3-bromopropyl)tetrahydro-10-methyl-, (4a.alpha.,5.alpha.,8.alpha.,8a.alpha.,10R*)-(.+-.)- |
| CAS Registry Number |
80471-43-8 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H24BrNO2 |
| InChI |
InChI=1S/C16H24BrNO2/c1-10-7-11-8-14(19)13(3-2-6-17)16(9-10)12(11)4-5-15(20)18-16/h10-13H,2-9H2,1H3,(H,18,20)/t10-,11-,12+,13-,16+/m1/s1 |
| InChIKey |
NGCLBDGJFLZYON-VBTGVMJWSA-N |
| Molecular Weight |
342.277 g/mol |
| SMILES |
N1C(CC[C@]2([C@]3(CC([C@]([C@@]12C[C@@](C3)(C)[H])(CCCBr)[H])=O)[H])[H])=O |
| SPLASH |
splash10-0udi-0090000000-8c071b3220ad62073827 |
| Source of Spectrum |
C-104-1067-0 |
| Synonyms |
(1S,6S,7R,10S,12R)-10-(3-bromopropyl)-12-methyl-2-azatricyclo[5.3.3.0(1,6)]tridecane-3,9-dione
(4aRS,5SR,8SR,8aRS,10RS)-8-(3-bromopropyl)-10-methylhexahydro-1H-5,8a-propanoquinolin-2,7(8H)-dione |
| Wiley ID |
1335801 |
