| SpectraBase Spectrum ID |
9fhd4Z9eHDm |
| Name |
25I-NB3B dehydro artifact |
| Classification |
Designer drug |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
472.948736789 u |
| Formula |
C17H17NO2BrI |
| InChI |
InChI=1S/C17H17BrINO2/c1-21-16-10-15(19)17(22-2)9-13(16)6-7-20-11-12-4-3-5-14(18)8-12/h3-10,20H,11H2,1-2H3/b7-6+ |
| InChIKey |
PGQKRWOHFOORJG-VOTSOKGWSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
474.136 g/mol |
| SMILES |
c1c(c(\C=C\NCc2cc(ccc2)Br)cc(OC)c1I)OC |
| SPLASH |
splash10-0005-3920100000-9c3c152d10d6a42ad9e9 |
| 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_9731 |
