SpectraBase Spectrum ID |
AY4qINQlqNO |
Name |
Methyl 4-phenyl-1-(4-(trifluoromethyl)phenyl)isoquinoline-3-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C24H16F3NO2 |
InChI |
InChI=1S/C24H16F3NO2/c1-30-23(29)22-20(15-7-3-2-4-8-15)18-9-5-6-10-19(18)21(28-22)16-11-13-17(14-12-16)24(25,26)27/h2-14H,1H3 |
InChIKey |
QDOCJUTUMOZTOK-UHFFFAOYSA-N |
Molecular Weight |
407.392 g/mol |
SMILES |
c1(nc(c(c2ccccc12)-c1ccccc1)C(=O)OC)-c1ccc(cc1)C(F)(F)F |
SPLASH |
splash10-0002-0019200000-862a92d30cf235a1142a |
Source of Spectrum |
OCF-3-516/SM12-3j |
Wiley ID |
1804804 |