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Fluoxetine-D6 TFA
SpectraBase Compound ID 3QALqJTY599
InChI InChI=1S/C19H17F6NO2/c1-26(17(27)19(23,24)25)12-11-16(13-5-3-2-4-6-13)28-15-9-7-14(8-10-15)18(20,21)22/h2-10,16H,11-12H2,1H3/i2D,3D,4D,5D,6D,16D
InChIKey NSUBYYSJDARHEI-ZQOPBQDMSA-N
Mol Weight 411.38 g/mol
Molecular Formula C19H11D6F6NO2
Exact Mass 411.154008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MEknmhC3E
Name Fluoxetine-D6 TFA
Classification Internal standard Antidepressant
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 411.154008243 u
Formula C19H11D6F6NO2
InChI InChI=1S/C19H17F6NO2/c1-26(17(27)19(23,24)25)12-11-16(13-5-3-2-4-6-13)28-15-9-7-14(8-10-15)18(20,21)22/h2-10,16H,11-12H2,1H3/i2D,3D,4D,5D,6D,16D
InChIKey NSUBYYSJDARHEI-ZQOPBQDMSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 411.377 g/mol
SMILES c1(c(c(c(c(c1[D])[D])[D])C(Oc1ccc(cc1)C(F)(F)F)(CCN(C)C(C(F)(F)F)=O)[D])[D])[D]
SPLASH splash10-0fdo-3920000000-efd153dbfa507fc7b9f8
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_7792