| SpectraBase Spectrum ID |
DllSMMHqe92 |
| Name |
Pentylone TFA |
| Classification |
Cathinone analog designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
331.103142484 u |
| Formula |
C15H16F3NO4 |
| InChI |
InChI=1S/C15H16F3NO4/c1-3-4-10(19(2)14(21)15(16,17)18)13(20)9-5-6-11-12(7-9)23-8-22-11/h5-7,10H,3-4,8H2,1-2H3 |
| InChIKey |
BMSZQJSHDINTLL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
331.291 g/mol |
| Nominal Mass |
331 u |
| Quality |
971 |
| Retention Index |
1939 |
| SMILES |
C(C(C=1C=C2C(=CC1)OCO2)=O)(N(C(C(F)(F)F)=O)C)CCC |
| SPLASH |
splash10-01bd-9700000000-58aba02dd1b8e60133ad |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(1-(1,3-benzodioxol-5-yl)-1-oxopentan-2-yl)(trifluoro)-N-methylacetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013050 |
