SpectraBase Spectrum ID |
JkN3ohpd5NF |
Name |
1-(5-Chloro-2-methoxyphenyl)naphthalen-2-yl trifluoromethanesulfonate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
416.009692225 u |
Formula |
C18H12ClF3O4S |
InChI |
InChI=1S/C18H12ClF3O4S/c1-25-15-9-7-12(19)10-14(15)17-13-5-3-2-4-11(13)6-8-16(17)26-27(23,24)18(20,21)22/h2-10H,1H3 |
InChIKey |
QBHQWNIRNZFVLQ-UHFFFAOYSA-N |
Molecular Weight |
416.798 g/mol |
SMILES |
C(S(=O)(=O)OC=1C(=C2C=CC=CC2=CC1)C=1C(=CC=C(C1)Cl)OC)(F)(F)F |