SpectraBase Spectrum ID |
5ZgNnv9fBC4 |
Name |
DFBDB FORM |
Classification |
Phenylbutanamine designer drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
257.086349606 u |
Formula |
C12H13F2NO3 |
InChI |
InChI=1S/C12H13F2NO3/c1-2-9(15-7-16)5-8-3-4-10-11(6-8)18-12(13,14)17-10/h3-4,6-7,9H,2,5H2,1H3,(H,15,16) |
InChIKey |
JAGCTWRTXSTYRX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
257.237 g/mol |
Nominal Mass |
257 u |
Quality |
968 |
Retention Index |
1764 |
SMILES |
C1(OC=2C(O1)=CC=C(C2)CC(NC=O)CC)(F)F |
SPLASH |
splash10-03dr-9350000000-58cf3b4222cb9fb78b13 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-[1-(2,2-Difluoro-2H-1,3-benzodioxol-5-yl)butan-2-yl]formamide |
Technique |
GC/MS |
Wiley ID |
DD2024_021245 |