| SpectraBase Spectrum ID |
AkkbfV3QHau |
| Name |
1-(4-(4-(Trifluoromethyl)phenyl)isoquinolin-1-yl)ethan-1-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H12F3NO |
| InChI |
InChI=1S/C18H12F3NO/c1-11(23)17-15-5-3-2-4-14(15)16(10-22-17)12-6-8-13(9-7-12)18(19,20)21/h2-10H,1H3 |
| InChIKey |
MUYAMQJGUKOLRS-UHFFFAOYSA-N |
| Instrument Name |
AMD 402 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901728 |
| Molecular Weight |
315.295 g/mol |
| Reported Formula |
C18H12F3NO |
| SMILES |
c1cc2c(cc1)c(ncc2-c1ccc(cc1)C(F)(F)F)C(=O)C |
| SPLASH |
splash10-0gbi-0094000000-59fa9c081ba0d86da7d4 |
| Source of Spectrum |
U1-2020-SM9-2ad |
| Wiley ID |
1858916 |
