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(4S*,5S*)-4-(Hydroxymethyl)-5-(6'-methoxy-2'-phenylselrnylmethylpyridin-3'-yl)cyclohex-2-en-1-one
SpectraBase Compound ID J04DlkWFuUe
InChI InChI=1S/C20H21NO3Se/c1-24-20-10-9-17(18-11-15(23)8-7-14(18)12-22)19(21-20)13-25-16-5-3-2-4-6-16/h2-10,14,18,22H,11-13H2,1H3/t14-,18+/m1/s1
InChIKey GIHKAHOPEAXNPG-KDOFPFPSSA-N
Mol Weight 402.36 g/mol
Molecular Formula C20H21NO3Se
Exact Mass 403.068666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 728F3kBjON0
Name (4S*,5S*)-4-(Hydroxymethyl)-5-(6'-methoxy-2'-phenylselrnylmethylpyridin-3'-yl)cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO3Se
InChI InChI=1S/C20H21NO3Se/c1-24-20-10-9-17(18-11-15(23)8-7-14(18)12-22)19(21-20)13-25-16-5-3-2-4-6-16/h2-10,14,18,22H,11-13H2,1H3/t14-,18+/m1/s1
InChIKey GIHKAHOPEAXNPG-KDOFPFPSSA-N
Molecular Weight 402.364 g/mol
SMILES OC[C@]1(C=CC(C[C@@]1(c1c(nc(cc1)OC)C[Se]c1ccccc1)[H])=O)[H]
SPLASH splash10-0f7k-0398200000-7ebb654bfa5a64e39fcb
Source of Spectrum F4-41-3417-19
Wiley ID 1672899