| SpectraBase Spectrum ID |
Do8bDIrW5o0 |
| Name |
5-TOET-A (-HN) HFB |
| Classification |
Designer drug derivative artifact |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
436.094312784 u |
| Formula |
C17H19F7O3S |
| InChI |
InChI=1S/C17H19F7O3S/c1-5-10-7-12(26-3)11(8-13(10)28-4)6-9(2)27-14(25)15(18,19)16(20,21)17(22,23)24/h7-9H,5-6H2,1-4H3 |
| InChIKey |
KYDNVSLYKSKILE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
436.385 g/mol |
| Nominal Mass |
436 u |
| Quality |
997 |
| Retention Index |
1745 |
| SMILES |
C(C(C(F)(F)F)(F)F)(C(OC(CC=1C(=CC(=C(C1)SC)CC)OC)C)=O)(F)F |
| SPLASH |
splash10-00dr-2940300000-bcce8337aa52fc243d1e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
O-Heptafluorobutyryl-1-(4-ethyl-2-methoxy-5-methylthiomethylphenyl)isopropan-2-ol
1-(4-ethyl-2-methoxy-5-methylthiophenyl)propan-2-yl 2,2,3,3,4,4,4-heptafluorobutanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_016862 |
