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3-Hydroxy-4-methoxytamoxifen, N-(trimethylsilyl)-
SpectraBase Compound ID GLvBg6HB6Ex
InChI InChI=1S/C30H39NO3Si/c1-8-27(25-16-19-28(32-4)29(22-25)34-35(5,6)7)30(23-12-10-9-11-13-23)24-14-17-26(18-15-24)33-21-20-31(2)3/h9-19,22H,8,20-21H2,1-7H3/b30-27-
InChIKey ZKJAUQADWVIOSL-IKPAITLHSA-N
Mol Weight 489.7 g/mol
Molecular Formula C30H39NO3Si
Exact Mass 489.269921 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8XcAHgWNdYl
Name 3-Hydroxy-4-methoxytamoxifen, N-(trimethylsilyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.269920652 u
Formula C30H39NO3Si
InChI InChI=1S/C30H39NO3Si/c1-8-27(25-16-19-28(32-4)29(22-25)34-35(5,6)7)30(23-12-10-9-11-13-23)24-14-17-26(18-15-24)33-21-20-31(2)3/h9-19,22H,8,20-21H2,1-7H3/b30-27-
InChIKey ZKJAUQADWVIOSL-IKPAITLHSA-N
Molecular Weight 489.731 g/mol
SMILES CC\C(=C/(C1=CC=CC=C1)C1=CC=C(C=C1)OCCN(C)C)C1=CC=C(C(=C1)O[Si](C)(C)C)OC