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(1-Oxidanylidene-1-phenylselanyl-tetradecan-4-yl) ethanoate

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

(1-Oxidanylidene-1-phenylselanyl-tetradecan-4-yl) ethanoate
SpectraBase Compound ID 7GvRlFAe6JG
InChI InChI=1S/C22H34O3Se/c1-3-4-5-6-7-8-9-11-14-20(25-19(2)23)17-18-22(24)26-21-15-12-10-13-16-21/h10,12-13,15-16,20H,3-9,11,14,17-18H2,1-2H3
InChIKey WVCAEORIWVFLIT-UHFFFAOYSA-N
Mol Weight 425.5 g/mol
Molecular Formula C22H34O3Se
Exact Mass 426.167317 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DvzSmTGJYPU
Name (1-Oxidanylidene-1-phenylselanyl-tetradecan-4-yl) ethanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.167316952 u
Formula C22H34O3Se
InChI InChI=1S/C22H34O3Se/c1-3-4-5-6-7-8-9-11-14-20(25-19(2)23)17-18-22(24)26-21-15-12-10-13-16-21/h10,12-13,15-16,20H,3-9,11,14,17-18H2,1-2H3
InChIKey WVCAEORIWVFLIT-UHFFFAOYSA-N
Molecular Weight 425.483 g/mol
SMILES C(C)(=O)OC(CCCCCCCCCC)CCC([Se]C=1C=CC=CC1)=O