| SpectraBase Spectrum ID |
GQvd0sG25Iv |
| Name |
Phenyl 7-(3-bromopropyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18BrNO2 |
| InChI |
InChI=1S/C18H18BrNO2/c19-12-6-7-14-13-15-8-4-5-11-17(14)20(15)18(21)22-16-9-2-1-3-10-16/h1-5,8-11,13,15,17H,6-7,12H2/t15-,17+/m0/s1 |
| InChIKey |
DCWRKVUPFAEGON-DOTOQJQBSA-N |
| Instrument Name |
Shimadzu GC??MS-QP2010 Plus |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901837 |
| Molecular Weight |
360.251 g/mol |
| Reported Formula |
C18H18BrNO2 |
| SMILES |
[C@]12(N([C@](C=C2CCCBr)(C=CC=C1)[H])C(=O)Oc1ccccc1)[H] |
| SPLASH |
splash10-0kvo-9530000000-24a31d84ec4b3d26be9a |
| Source of Spectrum |
U1-2020-SM14-3be |
| Thin-Layer Chromatography |
Rf = 0.54 (petroleum ether/ethyl acetate 15:1, 10:1, 5:1) |
| Wiley ID |
1858970 |
![Phenyl 7-(3-bromopropyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate](/api/spectrum/GQvd0sG25Iv/structure.png?h=300&w=458 "Phenyl 7-(3-bromopropyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate")
