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Ethyl 5-benzeneselenyl-2-(3-phenyl-2-propen-1-yl)pentanoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Ethyl 5-benzeneselenyl-2-(3-phenyl-2-propen-1-yl)pentanoate
SpectraBase Compound ID EGV2t03iWh3
InChI InChI=1S/C22H26O2Se/c1-2-24-22(23)20(14-9-13-19-11-5-3-6-12-19)15-10-18-25-21-16-7-4-8-17-21/h3-9,11-13,16-17,20H,2,10,14-15,18H2,1H3/b13-9+
InChIKey VSHZNNWPOGVERR-UKTHLTGXSA-N
Mol Weight 401.42 g/mol
Molecular Formula C22H26O2Se
Exact Mass 402.109802 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4iBR80hH7wi
Name Ethyl 5-benzeneselenyl-2-(3-phenyl-2-propen-1-yl)pentanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.109802075 u
Formula C22H26O2Se
InChI InChI=1S/C22H26O2Se/c1-2-24-22(23)20(14-9-13-19-11-5-3-6-12-19)15-10-18-25-21-16-7-4-8-17-21/h3-9,11-13,16-17,20H,2,10,14-15,18H2,1H3/b13-9+
InChIKey VSHZNNWPOGVERR-UKTHLTGXSA-N
Molecular Weight 401.420 g/mol
SMILES C(=O)(C(C\C=C\C1=CC=CC=C1)CCC[Se]C1=CC=CC=C1)OCC