| SpectraBase Spectrum ID |
20D6nXYkPod |
| Name |
1-(4-(Benzo[D][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2,2,3,3,3-pentafluoropropan-1-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.100283163 u |
| Formula |
C15H15F5N2O3 |
| InChI |
InChI=1S/C15H15F5N2O3/c16-14(17,15(18,19)20)13(23)22-5-3-21(4-6-22)8-10-1-2-11-12(7-10)25-9-24-11/h1-2,7H,3-6,8-9H2 |
| InChIKey |
BTAMMLYOKAOVFV-UHFFFAOYSA-N |
| Molecular Weight |
366.288 g/mol |
| SMILES |
C12=C(C=CC(=C2)CN2CCN(CC2)C(=O)C(F)(F)C(F)(F)F)OCO1 |
![1-(4-(Benzo[D][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2,2,3,3,3-pentafluoropropan-1-one](/api/spectrum/20D6nXYkPod/structure.png?h=300&w=458 "1-(4-(Benzo[D][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2,2,3,3,3-pentafluoropropan-1-one")
