| SpectraBase Spectrum ID |
3sLXejMVdo |
| Name |
25I-NB3OMe TFA |
| Classification |
Designer drug |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
523.046737645 u |
| Formula |
C20H21NO4IF3 |
| InChI |
InChI=1S/C20H21F3INO4/c1-27-15-6-4-5-13(9-15)12-25(19(26)20(21,22)23)8-7-14-10-18(29-3)16(24)11-17(14)28-2/h4-6,9-11H,7-8,12H2,1-3H3 |
| InChIKey |
WFMXGPCJQGIUOB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
523.291 g/mol |
| SMILES |
c1c(OC)c(cc(OC)c1I)CCN(Cc1cc(ccc1)OC)C(=O)C(F)(F)F |
| SPLASH |
splash10-0096-5690000000-357de1c996a3a4f507a1 |
| 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_9751 |
