| SpectraBase Spectrum ID |
GOQKGHOoC |
| Name |
25I-NB3OMe PFP |
| Classification |
Designer drug |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
573.043543971 u |
| Formula |
C21H21NO4IF5 |
| InChI |
InChI=1S/C21H21F5INO4/c1-30-15-6-4-5-13(9-15)12-28(19(29)20(22,23)21(24,25)26)8-7-14-10-18(32-3)16(27)11-17(14)31-2/h4-6,9-11H,7-8,12H2,1-3H3 |
| InChIKey |
VAVXHSFKVIYJFP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
573.298 g/mol |
| SMILES |
c1c(c(cc(OC)c1I)CCN(C(=O)C(F)(F)C(F)(F)F)Cc1cc(ccc1)OC)OC |
| SPLASH |
splash10-0096-3590000000-b8ee08f31641caad2610 |
| 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_9752 |
