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Doxepin-M -(CH3)2NOH AC
SpectraBase Compound ID 8z0HUnXSjDF
InChI InChI=1S/C19H16O3/c1-3-6-17-16-8-5-4-7-14(16)12-21-19-10-9-15(11-18(17)19)22-13(2)20/h3-11H,1,12H2,2H3/b17-6+
InChIKey DDSRJGFXEZWOAR-UBKPWBPPSA-N
Mol Weight 292.33 g/mol
Molecular Formula C19H16O3
Exact Mass 292.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8r9gtartzux
Name Doxepin-M -(CH3)2NOH AC
Classification Antidepressant
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 292.109944372 u
Formula C19H16O3
InChI InChI=1S/C19H16O3/c1-3-6-17-16-8-5-4-7-14(16)12-21-19-10-9-15(11-18(17)19)22-13(2)20/h3-11H,1,12H2,2H3/b17-6+
InChIKey DDSRJGFXEZWOAR-UBKPWBPPSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 292.334 g/mol
SMILES c12c(\C(=C\C=C)c3ccccc3CO1)cc(cc2)OC(C)=O
SPLASH splash10-0fsu-1590000000-87892de9c3eaf6e50f64
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 Doxepin-M (HO-N-oxide) -(CH3)2NOH AC
Technique GC/MS
Wiley ID MMPW6e_335