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Doxylamine-M (Bisdesmethyl) AC
SpectraBase Compound ID HM6Yd9MQyoQ
InChI InChI=1S/C17H20N2O2/c1-14(20)18-12-13-21-17(2,15-8-4-3-5-9-15)16-10-6-7-11-19-16/h3-11H,12-13H2,1-2H3,(H,18,20)
InChIKey KBRKOHNZOGAGHG-UHFFFAOYSA-N
Mol Weight 284.36 g/mol
Molecular Formula C17H20N2O2
Exact Mass 284.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7POqzoTjXPt
Name Doxylamine-M (bis-nor-) AC
Classification Antihistamine
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Exact Mass 284.152477890 u
Formula C17H20N2O2
InChI InChI=1S/C17H20N2O2/c1-14(20)18-12-13-21-17(2,15-8-4-3-5-9-15)16-10-6-7-11-19-16/h3-11H,12-13H2,1-2H3,(H,18,20)
InChIKey KBRKOHNZOGAGHG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 284.359 g/mol
SMILES c1(ccccc1)C(c1ncccc1)(OCCNC(C)=O)C
SPLASH splash10-001i-3900000000-029b7933241aa1b3f718
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
Technique GC/MS
Wiley ID MMPW6e_746