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2C-E-M isomer-1 2TFA
SpectraBase Compound ID FSWKKtpUQwJ
InChI InChI=1S/C17H17F6NO5/c1-4-10-7-13(29-15(27)17(21,22)23)11(8-12(10)28-3)5-6-24(9(2)25)14(26)16(18,19)20/h7-8H,4-6H2,1-3H3
InChIKey RGOXAHHFGWBWGD-UHFFFAOYSA-N
Mol Weight 429.32 g/mol
Molecular Formula C17H17F6NO5
Exact Mass 429.101092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLIaSP8wFu7
Name 2C-E-M isomer-1 2TFA
Classification Designer drug
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Exact Mass 429.101091624 u
Formula C17H17NO5F6
InChI InChI=1S/C17H17F6NO5/c1-4-10-7-13(29-15(27)17(21,22)23)11(8-12(10)28-3)5-6-24(9(2)25)14(26)16(18,19)20/h7-8H,4-6H2,1-3H3
InChIKey RGOXAHHFGWBWGD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 429.315 g/mol
SMILES c1(OC)cc(c(cc1CC)OC(=O)C(F)(F)F)CCN(C(C)=O)C(=O)C(F)(F)F
SPLASH splash10-05fr-0091000000-d33e721e792d99ec741b
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- N-acetyl-) isomer-1 TFA 4-Ethyl-2,5-dimethoxyphenethylamine-M (O-demethyl- N-acetyl-) isomer-1 2TFA
Technique GC/MS
Wiley ID MMPW6e_7110