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Venlafaxine-M (nor-) -H2O PFP
SpectraBase Compound ID 8pKgyccmBci
InChI InChI=1S/C19H22F5NO2/c1-25(17(26)18(20,21)19(22,23)24)12-16(13-6-4-3-5-7-13)14-8-10-15(27-2)11-9-14/h6,8-11,16H,3-5,7,12H2,1-2H3
InChIKey XAKDKWZUAOGJGD-UHFFFAOYSA-N
Mol Weight 391.38 g/mol
Molecular Formula C19H22F5NO2
Exact Mass 391.15707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOzyYsEu8
Name Venlafaxine-M (nor-) -H2O PFP
Classification Antidepressant
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Exact Mass 391.157069765 u
Formula C19H22NO2F5
InChI InChI=1S/C19H22F5NO2/c1-25(17(26)18(20,21)19(22,23)24)12-16(13-6-4-3-5-7-13)14-8-10-15(27-2)11-9-14/h6,8-11,16H,3-5,7,12H2,1-2H3
InChIKey XAKDKWZUAOGJGD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 391.382 g/mol
SMILES c1(C(C=2CCCCC2)CN(C)C(C(F)(F)C(F)(F)F)=O)ccc(OC)cc1
SPLASH splash10-0gbc-2910000000-ac1e67065289cbd55e14
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.
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_7694