![10.beta.-[2-(4-Trifluoromethylphenyl)allyl]deoxoartemisinin](/api/spectrum/KTwvX3Eda98/structure.png?h=300&w=458 "10.beta.-[2-(4-Trifluoromethylphenyl)allyl]deoxoartemisinin")
| SpectraBase Compound ID | 2QUXODOG6fN |
|---|---|
| InChI | InChI=1S/C25H31F3O4/c1-14-5-10-20-16(3)21(13-15(2)17-6-8-18(9-7-17)25(26,27)28)29-22-24(20)19(14)11-12-23(4,30-22)31-32-24/h6-9,14,16,19-22H,2,5,10-13H2,1,3-4H3/t14-,16-,19+,20+,21-,22-,23-,24-/m1/s1 |
| InChIKey | REAJFBUSFDNHCR-UBCXGJNISA-N |
| Mol Weight | 452.51 g/mol |
| Molecular Formula | C25H31F3O4 |
| Exact Mass | 452.217444 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KTwvX3Eda98 |
|---|---|
| Name | 10.beta.-[2-(4-Trifluoromethylphenyl)allyl]deoxoartemisinin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H31F3O4 |
| InChI | InChI=1S/C25H31F3O4/c1-14-5-10-20-16(3)21(13-15(2)17-6-8-18(9-7-17)25(26,27)28)29-22-24(20)19(14)11-12-23(4,30-22)31-32-24/h6-9,14,16,19-22H,2,5,10-13H2,1,3-4H3/t14-,16-,19+,20+,21-,22-,23-,24-/m1/s1 |
| InChIKey | REAJFBUSFDNHCR-UBCXGJNISA-N |
| Molecular Weight | 452.514 g/mol |
| SMILES | [C@]123[C@]4(O[C@@](OO3)(C)CC[C@]1([C@@](CC[C@]2([C@]([C@@](CC(c1ccc(C(F)(F)F)cc1)=C)(O4)[H])(C)[H])[H])(C)[H])[H])[H] |
| SPLASH | splash10-06r6-9700000000-a4d9c3189ea4e6daffdc |
| Source of Spectrum | K-2001-2688-11 |
| Wiley ID | 1579896 |