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4-Hydroxy-(tetradeuterio)-tebufelone - bis(trimethylsilyl) derivative
SpectraBase Compound ID CemNA0AzAAD
InChI InChI=1S/C26H44O3Si2/c1-14-15-20(28-30(8,9)10)18-23(27)19-16-21(25(2,3)4)24(29-31(11,12)13)22(17-19)26(5,6)7/h1,16-17,20H,15,18H2,2-13H3/i15D2,18D2
InChIKey KJFWEHNQORBSNE-ZYIXTJEASA-N
Mol Weight 464.8 g/mol
Molecular Formula C26H402D4O3Si2
Exact Mass 464.308005 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1O5z5o7f75M
Name 4-Hydroxy-(tetradeuterio)-tebufelone - bis(trimethylsilyl) derivative
Alternate Name(s) 2,6-bis(t-Butyl)-4-[(1',1',3',3'-tetradeuterio-3'-hydroxy-4'-pentynyl)carbonyl)phenol 1,3'-bis(-trimethylsil) derivative
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40D4O3Si2
InChI InChI=1S/C26H44O3Si2/c1-14-15-20(28-30(8,9)10)18-23(27)19-16-21(25(2,3)4)24(29-31(11,12)13)22(17-19)26(5,6)7/h1,16-17,20H,15,18H2,2-13H3/i15D2,18D2
InChIKey KJFWEHNQORBSNE-ZYIXTJEASA-N
Molecular Weight 464.829 g/mol
SMILES c1(c(cc(C(C(C(O[Si](C)(C)C)C(C#C)([2D])[2D])([2D])[2D])=O)cc1C(C)(C)C)C(C)(C)C)O[Si](C)(C)C
SPLASH splash10-05fr-0009200000-742af2e5093c2f509a0c
Source of Spectrum O-32-1293-0
Wiley ID 762978