SpectraBase Spectrum ID |
1a58co4g7n2 |
Name |
ethyl 6'-bromo-3'-cyano-2'-fluorobiphenyl-4-carboxylate |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H11BrFNO2 |
InChI |
InChI=1S/C16H11BrFNO2/c1-2-21-16(20)11-5-3-10(4-6-11)14-13(17)8-7-12(9-19)15(14)18/h3-8H,2H2,1H3 |
InChIKey |
FFPHTEINDNDKPB-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT95Q |
Ionization Type |
EI |
Molecular Weight |
348.171 g/mol |
Reported Formula |
C16H11BrFNO2 |
SMILES |
c1(ccc(cc1)C(=O)OCC)-c1c(c(ccc1Br)C#N)F |
SPLASH |
splash10-0udj-0209000000-a661b0469f738cd4d1a8 |
Source of Spectrum |
EP3168224A1 |
Wiley ID |
1855237 |