SpectraBase Spectrum ID |
2qqJacHlD6 |
Name |
MDEA S-(+)-enantiomer HFBP |
Classification |
Psychedelic
Designer drug |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
500.154604366 u |
Formula |
C21H23F7N2O4 |
InChI |
InChI=1S/C21H23F7N2O4/c1-3-29(12(2)9-13-6-7-15-16(10-13)34-11-33-15)17(31)14-5-4-8-30(14)18(32)19(22,23)20(24,25)21(26,27)28/h6-7,10,12,14H,3-5,8-9,11H2,1-2H3 |
InChIKey |
XKTIAAWCCFRLDO-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
500.414 g/mol |
SMILES |
C(C1CCCN1C(=O)C(C(F)(F)C(F)(F)F)(F)F)(N(C(Cc1cc2c(cc1)OCO2)C)CC)=O |
SPLASH |
splash10-02t9-2790000000-40807d8c8e54d4bda82a |
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_6645 |