| SpectraBase Spectrum ID |
1S38DK44022 |
| Name |
Methyl 6-bromo-2-(3-(pyridin-2-yl)phenyl)hexanoate |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20BrNO2 |
| InChI |
InChI=1S/C18H20BrNO2/c1-22-18(21)16(9-2-4-11-19)14-7-6-8-15(13-14)17-10-3-5-12-20-17/h3,5-8,10,12-13,16H,2,4,9,11H2,1H3 |
| InChIKey |
VGPMFQVAGKOUBD-UHFFFAOYSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202003622 |
| Molecular Weight |
362.267 g/mol |
| Reported Formula |
C17H18(79)BrNO2 |
| SMILES |
COC(=O)C(c1cccc(-c2ccccn2)c1)CCCCBr |
| SPLASH |
splash10-014i-0390000000-ed63e3f9b2ad07d1b456 |
| Source of Spectrum |
QE-26-SM66-3ae |
| Wiley ID |
1841186 |
