| SpectraBase Spectrum ID |
6xrucmviGwT |
| Name |
2C-E-M isomer-1 -H2O TFA |
| Classification |
Designer drug |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
331.103142484 u |
| Formula |
C15H16NO4F3 |
| InChI |
InChI=1S/C15H16F3NO4/c1-4-10-7-13(23-14(21)15(16,17)18)11(8-12(10)22-3)5-6-19-9(2)20/h4,7-8H,1,5-6H2,2-3H3,(H,19,20) |
| InChIKey |
YKKYFNQYPWASKF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
331.291 g/mol |
| SMILES |
C(C(Oc1cc(C=C)c(cc1CCNC(C)=O)OC)=O)(F)(F)F |
| SPLASH |
splash10-00di-7960000000-36dcfaf3ce64089a21e8 |
| 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 |
| Synonyms |
2C-E-M (O-demethyl-HO- N-acetyl-) isomer-1 -HO TFA
4-Ethyl-2,5-dimethoxyphenethylamine-M (O-demethyl-HO- N-acetyl-) iso-1 -H2O TFA |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_7112 |
