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DOI-M (O-desmethyl-) isomer-2 2AC
SpectraBase Compound ID HErPcJwqhe2
InChI InChI=1S/C14H18INO4/c1-8(16-9(2)17)5-11-6-14(20-10(3)18)12(15)7-13(11)19-4/h6-8H,5H2,1-4H3,(H,16,17)
InChIKey IAFPSZVVYOIAHJ-UHFFFAOYSA-N
Mol Weight 391.21 g/mol
Molecular Formula C14H18INO4
Exact Mass 391.028053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bh55ERbhXVV
Name DOI-M (O-desmethyl-) isomer-2 2AC
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 391.028053060 u
Formula C14H18NO4I
InChI InChI=1S/C14H18INO4/c1-8(16-9(2)17)5-11-6-14(20-10(3)18)12(15)7-13(11)19-4/h6-8H,5H2,1-4H3,(H,16,17)
InChIKey IAFPSZVVYOIAHJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 391.205 g/mol
SMILES c1(cc(CC(NC(=O)C)C)c(OC)cc1I)OC(C)=O
SPLASH splash10-0006-3193000000-a2d9f0f467591099a6b3
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.
Sample Preparation Procedure Detected: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms DOI-M (O-demethyl-) isomer-2 2AC 4-Iodo-2,5-dimethoxy-amfetamine-M (O-demethyl-) isomer-2 2AC
Technique GC/MS
Wiley ID MMPW6e_7181