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10-[Tert-butyl(diphenyl)silyl]oxy-1-(1,3-dithian-2-yl)-4-hydroxy-decan-3-one

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

10-[Tert-butyl(diphenyl)silyl]oxy-1-(1,3-dithian-2-yl)-4-hydroxy-decan-3-one
SpectraBase Compound ID FHlav0UhdvK
InChI InChI=1S/C30H44O3S2Si/c1-30(2,3)36(25-15-8-6-9-16-25,26-17-10-7-11-18-26)33-22-13-5-4-12-19-27(31)28(32)20-21-29-34-23-14-24-35-29/h6-11,15-18,27,29,31H,4-5,12-14,19-24H2,1-3H3
InChIKey IEKKBLRLPMJKSI-UHFFFAOYSA-N
Mol Weight 544.9 g/mol
Molecular Formula C30H44O3S2Si
Exact Mass 544.250114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KG8hWAnh30
Name 10-[Tert-butyl(diphenyl)silyl]oxy-1-(1,3-dithian-2-yl)-4-hydroxy-decan-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 544.250114157 u
Formula C30H44O3S2Si
InChI InChI=1S/C30H44O3S2Si/c1-30(2,3)36(25-15-8-6-9-16-25,26-17-10-7-11-18-26)33-22-13-5-4-12-19-27(31)28(32)20-21-29-34-23-14-24-35-29/h6-11,15-18,27,29,31H,4-5,12-14,19-24H2,1-3H3
InChIKey IEKKBLRLPMJKSI-UHFFFAOYSA-N
Molecular Weight 544.884 g/mol
SMILES C([Si](C1=CC=CC=C1)(C1=CC=CC=C1)OCCCCCCC(C(=O)CCC1SCCCS1)O)(C)(C)C