| SpectraBase Spectrum ID |
HYDO6P1QBsA |
| Name |
2-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-one |
| Alternate Name(s) |
2-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-6,8-dioxabicyclo[3.2.1]octan-4-one
2-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-6,8-dioxabicyclo[3.2.1]octan-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H13F3N2O5S |
| InChI |
InChI=1S/C18H13F3N2O5S/c19-18(20,21)15-4-9(8-1-2-11-12(3-8)27-7-26-11)22-17(23-15)29-14-5-10(24)16-25-6-13(14)28-16/h1-4,13-14,16H,5-7H2/t13-,14+,16-/m1/s1 |
| InChIKey |
LDZURKXERCVMTD-IJEWVQPXSA-N |
| Molecular Weight |
426.366 g/mol |
| SMILES |
c1(nc(C(F)(F)F)cc(n1)-c1cc2OCOc2cc1)S[C@@]1([C@@]2(O[C@](C(C1)=O)(OC2)[H])[H])[H] |
| SPLASH |
splash10-0005-9111000000-ffb4af574fe880d2ba37 |
| Wiley ID |
1463965 |
![(1R,2S,5R)-2-((4-(benzo[d][1,3]dioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)-6,8-dioxabicyclo[3.2.1]octan-4-one](/api/spectrum/HYDO6P1QBsA/structure.png?h=300&w=458 "(1R,2S,5R)-2-((4-(benzo[d][1,3]dioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)-6,8-dioxabicyclo[3.2.1]octan-4-one")
