| SpectraBase Spectrum ID |
BrOarILZxO3 |
| Name |
5-[4-(4-bromobutoxy)phenyl]-2-octylpyrimidine |
| Appearance |
Colourless crystalline solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H31BrN2O |
| InChI |
InChI=1S/C22H31BrN2O/c1-2-3-4-5-6-7-10-22-24-17-20(18-25-22)19-11-13-21(14-12-19)26-16-9-8-15-23/h11-14,17-18H,2-10,15-16H2,1H3 |
| InChIKey |
ZQVDMRJMDZMCGG-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 and Varian MAT 711 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.5.63 |
| Molecular Weight |
419.407 g/mol |
| SMILES |
C(Br)CCCOc1ccc(cc1)-c1cnc(nc1)CCCCCCCC |
| SPLASH |
splash10-00di-1209600000-a591bd947031835ecff5 |
| Source of Spectrum |
BJO-5-SM3-3c |
| Thin-Layer Chromatography |
Rf = 0.47 (PE/EtOAc, 5:1) |
| Wiley ID |
1871633 |
![5-[4-(4-bromobutoxy)phenyl]-2-octylpyrimidine](/api/spectrum/BrOarILZxO3/structure.png?h=300&w=458 "5-[4-(4-bromobutoxy)phenyl]-2-octylpyrimidine")
