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N-Desmethylcitalopram, N-trimethylsilyl-
SpectraBase Compound ID LXR5vKpu2Zd
InChI InChI=1S/C22H27FN2OSi/c1-25(27(2,3)4)13-5-12-22(19-7-9-20(23)10-8-19)21-11-6-17(15-24)14-18(21)16-26-22/h6-11,14H,5,12-13,16H2,1-4H3
InChIKey PZLHPSFIDZMPFK-UHFFFAOYSA-N
Mol Weight 382.55 g/mol
Molecular Formula C22H27FN2OSi
Exact Mass 382.187668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1fJkTwjWHZ9
Name N-Desmethylcitalopram, N-trimethylsilyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.187668194 u
Formula C22H27FN2OSi
InChI InChI=1S/C22H27FN2OSi/c1-25(27(2,3)4)13-5-12-22(19-7-9-20(23)10-8-19)21-11-6-17(15-24)14-18(21)16-26-22/h6-11,14H,5,12-13,16H2,1-4H3
InChIKey PZLHPSFIDZMPFK-UHFFFAOYSA-N
Molecular Weight 382.554 g/mol
SMILES CN(CCCC1(C2=CC=C(C=C2CO1)C#N)C1=CC=C(C=C1)F)[Si](C)(C)C