| SpectraBase Spectrum ID |
6c93VVvWwQg |
| Name |
Pentylone HFB |
| Classification |
Designer drug |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
431.096755136 u |
| Formula |
C17H16NO4F7 |
| InChI |
InChI=1S/C17H16F7NO4/c1-3-4-10(13(26)9-5-6-11-12(7-9)29-8-28-11)25(2)14(27)15(18,19)16(20,21)17(22,23)24/h5-7,10H,3-4,8H2,1-2H3 |
| InChIKey |
FYOCUBJOKGKXQO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
431.307 g/mol |
| SMILES |
c12cc(C(=O)C(N(C(C(F)(F)C(F)(F)C(F)(F)F)=O)C)CCC)ccc1OCO2 |
| SPLASH |
splash10-00kb-5940000000-4b434fbfdfc1a9455cc1 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_10459 |
