| SpectraBase Spectrum ID |
4kLtf6XdQpU |
| Name |
(6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl)methyl 2,3,4,5,6-pentafluorobenzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.099220536 u |
| Formula |
C17H15F5O2 |
| InChI |
InChI=1S/C17H15F5O2/c1-17(2)8-4-3-7(9(17)5-8)6-24-16(23)10-11(18)13(20)15(22)14(21)12(10)19/h3,8-9H,4-6H2,1-2H3 |
| InChIKey |
NVADTXGNFOKTEH-UHFFFAOYSA-N |
| Molecular Weight |
346.297 g/mol |
| SMILES |
C(=O)(C1=C(C(=C(C(=C1F)F)F)F)F)OCC=1C2C(C(C2)CC1)(C)C |
![(6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl)methyl 2,3,4,5,6-pentafluorobenzoate](/api/spectrum/4kLtf6XdQpU/structure.png?h=300&w=458 "(6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl)methyl 2,3,4,5,6-pentafluorobenzoate")
