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2C-E-M (O-demethyl-HO-) 3TFA
SpectraBase Compound ID 1dwElbfHJIe
InChI InChI=1S/C17H14F9NO6/c1-31-10-6-8(2-4-27-12(28)15(18,19)20)11(33-14(30)17(24,25)26)7-9(10)3-5-32-13(29)16(21,22)23/h6-7H,2-5H2,1H3,(H,27,28)
InChIKey FQJNHHCXODUBKZ-UHFFFAOYSA-N
Mol Weight 499.29 g/mol
Molecular Formula C17H14F9NO6
Exact Mass 499.067741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QeMFEZ3pHT
Name 2C-E-M (O-demethyl-HO-) 3TFA
Classification Designer drug
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Exact Mass 499.067740636 u
Formula C17H14NO6F9
InChI InChI=1S/C17H14F9NO6/c1-31-10-6-8(2-4-27-12(28)15(18,19)20)11(33-14(30)17(24,25)26)7-9(10)3-5-32-13(29)16(21,22)23/h6-7H,2-5H2,1H3,(H,27,28)
InChIKey FQJNHHCXODUBKZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 499.286 g/mol
SMILES C(C(Oc1cc(c(cc1CCNC(C(F)(F)F)=O)OC)CCOC(C(F)(F)F)=O)=O)(F)(F)F
SPLASH splash10-00di-2229000000-38fa3b43fab8384b3a23
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 4-Ethyl-2,5-dimethoxyphenethylamine-M (O-demethyl-HO-) 3TFA
Technique GC/MS
Wiley ID MMPW6e_7124