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DOC-M (O-demethyl-) isomer-1 2AC
SpectraBase Compound ID F4sGRpPPV5T
InChI InChI=1S/C14H18ClNO4/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 RNXMYFLKRFTLMW-UHFFFAOYSA-N
Mol Weight 299.75 g/mol
Molecular Formula C14H18ClNO4
Exact Mass 299.092436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Anv6qxom5I1
Name DOC-M (O-demethyl-) isomer-1 2AC
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 299.092435760 u
Formula C14H18NO4Cl
InChI InChI=1S/C14H18ClNO4/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 RNXMYFLKRFTLMW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 299.754 g/mol
SMILES c1(c(cc(c(c1)Cl)OC(C)=O)CC(NC(C)=O)C)OC
SPLASH splash10-0005-3960000000-325f1133649d31063bff
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 4-Chloro-2,5-dimethoxy-amfetamine-M (O-demethyl-) isomer-1 2AC
Technique GC/MS
Wiley ID MMPW6e_7855