SpectraBase Spectrum ID |
DOTBSN6rl0L |
Name |
1-(4-(3,4-Dimethoxybenzoyl)piperazin-1-yl)-2,2,2-trifluoroethanone |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
346.114041520 u |
Formula |
C15H17F3N2O4 |
InChI |
InChI=1S/C15H17F3N2O4/c1-23-11-4-3-10(9-12(11)24-2)13(21)19-5-7-20(8-6-19)14(22)15(16,17)18/h3-4,9H,5-8H2,1-2H3 |
InChIKey |
IDLWZTUAAATEGT-UHFFFAOYSA-N |
Molecular Weight |
346.306 g/mol |
SMILES |
C1(=C(C=CC(=C1)C(=O)N1CCN(CC1)C(=O)C(F)(F)F)OC)OC |