For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2C-E-M (HO-) 2TFA
SpectraBase Compound ID 1WgflXhMLk0
InChI InChI=1S/C16H17F6NO5/c1-26-11-8-10(4-6-28-14(25)16(20,21)22)12(27-2)7-9(11)3-5-23-13(24)15(17,18)19/h7-8H,3-6H2,1-2H3,(H,23,24)
InChIKey JXRGJNVLLMKCSX-UHFFFAOYSA-N
Mol Weight 417.3 g/mol
Molecular Formula C16H17F6NO5
Exact Mass 417.101092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID F5x4IyuYOzF
Name 2C-E-M (HO-) 2TFA
Classification Designer drug
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 417.101091624 u
Formula C16H17NO5F6
InChI InChI=1S/C16H17F6NO5/c1-26-11-8-10(4-6-28-14(25)16(20,21)22)12(27-2)7-9(11)3-5-23-13(24)15(17,18)19/h7-8H,3-6H2,1-2H3,(H,23,24)
InChIKey JXRGJNVLLMKCSX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 417.304 g/mol
SMILES C(C(OCCc1c(OC)cc(CCNC(=O)C(F)(F)F)c(OC)c1)=O)(F)(F)F
SPLASH splash10-0fbc-0912100000-7aa811adece607871727
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 (HO-) TFA 4-Ethyl-2,5-dimethoxyphenethylamine-M (HO-) 2TFA
Technique GC/MS
Wiley ID MMPW6e_7121