SpectraBase Spectrum ID |
Hujsbno990J |
Name |
2C-B-FLY-NBOMe artifact (-4H) |
Classification |
Designer drug |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
399.047006441 u |
Formula |
C20H18NO3Br |
InChI |
InChI=1S/C20H18BrNO3/c1-23-17-5-3-2-4-13(17)12-22-9-6-14-15-7-10-25-20(15)18(21)16-8-11-24-19(14)16/h2-5,7-8,10-11,22H,6,9,12H2,1H3 |
InChIKey |
LCDILTHFEKYSGE-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
400.272 g/mol |
SMILES |
c1cccc(CNCCc2c3c(c(c4c2cco4)Br)cco3)c1OC |
SPLASH |
splash10-0fk9-2910000000-ed089697c193c2c97db7 |
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_10822 |