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Paroxetine
SpectraBase Compound ID 31iWZ0aC88k
InChI InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1
InChIKey AHOUBRCZNHFOSL-YOEHRIQHSA-N
Mol Weight 329.37 g/mol
Molecular Formula C19H20FNO3
Exact Mass 329.142722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFn8fxMq0gq
Name Paroxetine I
Classification Serotonin reuptake inhibitor(SRI)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 329.142721668 u
Formula C19H20FNO3
InChI InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1
InChIKey AHOUBRCZNHFOSL-YOEHRIQHSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 329.371 g/mol
Nominal Mass 329 u
Quality 989
Retention Index 2590
SMILES [C@]1([C@@](CNCC1)(COC=1C=C2C(=CC1)OCO2)[H])(C1=CC=C(C=C1)F)[H]
SPLASH splash10-0006-9701000000-cd1eb1b9975508afe7f5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Piperidine,(3s,4R)-3-(Benzo[1,3]dioxol-5-yloxymethyl)-4-(4-fluorophenyl) (3S,4R)-3-(Benzo[1,3]dioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine
Technique GC/MS
Wiley ID DD2024_010280