| SpectraBase Spectrum ID |
F3EHKNGHjel |
| Name |
3-[2,3,5,6-tetrafluoro-4-trifluoromethyl)phenoxy]pregna-3,5-diene-20-one |
| Alternate Name(s) |
3-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenoxy]pregna-3,5-dien-20-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H29F7O2 |
| InChI |
InChI=1S/C28H29F7O2/c1-13(36)17-6-7-18-16-5-4-14-12-15(8-10-26(14,2)19(16)9-11-27(17,18)3)37-25-23(31)21(29)20(28(33,34)35)22(30)24(25)32/h4,12,16-19H,5-11H2,1-3H3/t16-,17+,18-,19-,26-,27+/m0/s1 |
| InChIKey |
FUDBFPBXEAIQKI-GLPKTCBPSA-N |
| Molecular Weight |
530.527 g/mol |
| SMILES |
c1(c(c(F)c(c(c1F)F)OC1=CC2=CC[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@@]3([C@]2(CC1)C)[H])C)(C(=O)C)[H])[H])[H])F)C(F)(F)F |
| SPLASH |
splash10-0006-9000000000-d7e797628ed9143bf1a3 |
| Source of Spectrum |
KC-1987-1131-6 |
| Wiley ID |
1403321 |
![3-[2,3,5,6-tetrafluoro-4-trifluoromethyl)phenoxy]pregna-3,5-diene-20-one](/api/spectrum/F3EHKNGHjel/structure.png?h=300&w=458 "3-[2,3,5,6-tetrafluoro-4-trifluoromethyl)phenoxy]pregna-3,5-diene-20-one")
