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Venlafaxine-M -H2O AC
SpectraBase Compound ID HPPXkSFLNds
InChI InChI=1S/C18H25NO2/c1-14(20)21-17-11-9-16(10-12-17)18(13-19(2)3)15-7-5-4-6-8-15/h7,9-12,18H,4-6,8,13H2,1-3H3
InChIKey HOLOTJWVNKXGIH-UHFFFAOYSA-N
Mol Weight 287.4 g/mol
Molecular Formula C18H25NO2
Exact Mass 287.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAhS26ZV5Z0
Name Venlafaxine-M -H2O AC
Classification Antidepressant
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Exact Mass 287.188529047 u
Formula C18H25NO2
InChI InChI=1S/C18H25NO2/c1-14(20)21-17-11-9-16(10-12-17)18(13-19(2)3)15-7-5-4-6-8-15/h7,9-12,18H,4-6,8,13H2,1-3H3
InChIKey HOLOTJWVNKXGIH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.403 g/mol
Related CAS Registry Number(s) 93413-69-5
SMILES C(c1ccc(OC(C)=O)cc1)(CN(C)C)C=1CCCCC1
SPLASH splash10-0a4i-9100000000-480b0cb8d11da4949ce5
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 Venlafaxine-M (O-demethyl-) -H2O AC
Technique GC/MS
Wiley ID MMPW6e_7185