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Protriptyline-M (nor-10,11-dihydro-di-HO-) MS2
SpectraBase Compound ID K3eipveFFeq
InChI InChI=1S/C18H21NO2/c19-11-5-10-12-13-6-1-3-8-15(13)17(20)18(21)16-9-4-2-7-14(12)16/h1-4,6-9,12,17-18,20-21H,5,10-11,19H2
InChIKey LVHGIOGTMIQTOS-UHFFFAOYSA-N
Mol Weight 283.37 g/mol
Molecular Formula C18H21NO2
Exact Mass 283.157229 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 6p7xlFzUTQ
Name Protriptyline-M (nor-10,11-dihydro-di-HO-) MS2
Comments F: ITMS + c ESI d w Full ms2 284.10
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Formula C18H21NO2
InChI InChI=1S/C18H21NO2/c19-11-5-10-12-13-6-1-3-8-15(13)17(20)18(21)16-9-4-2-7-14(12)16/h1-4,6-9,12,17-18,20-21H,5,10-11,19H2
InChIKey LVHGIOGTMIQTOS-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES NCCCC1C2=C(C(C(C=3C1=CC=CC3)O)O)C=CC=C2
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS