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(1S)-1-(4-Methoxyphenyl)-4-(phenylseleno)butan-1-ol

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

(1S)-1-(4-Methoxyphenyl)-4-(phenylseleno)butan-1-ol
SpectraBase Compound ID 3P3Fp276o07
InChI InChI=1S/C17H20O2Se/c1-19-15-11-9-14(10-12-15)17(18)8-5-13-20-16-6-3-2-4-7-16/h2-4,6-7,9-12,17-18H,5,8,13H2,1H3/t17-/m0/s1
InChIKey ROQRONLKIRAINO-KRWDZBQOSA-N
Mol Weight 335.32 g/mol
Molecular Formula C17H20O2Se
Exact Mass 336.062852 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hhWnXeJDuy
Name (1S)-1-(4-Methoxyphenyl)-4-(phenylseleno)butan-1-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.062851882 u
Formula C17H20O2Se
InChI InChI=1S/C17H20O2Se/c1-19-15-11-9-14(10-12-15)17(18)8-5-13-20-16-6-3-2-4-7-16/h2-4,6-7,9-12,17-18H,5,8,13H2,1H3/t17-/m0/s1
InChIKey ROQRONLKIRAINO-KRWDZBQOSA-N
Molecular Weight 335.317 g/mol
SMILES C1([C@](CCC[Se]C=2C=CC=CC2)(O)[H])=CC=C(C=C1)OC