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2-Cyclohexen-1-one, 6-[3-iodo-2,2-dimethyl-1-[(trimethylsilyl)oxy]propyl]-2-methyl-5-(1-methylethenyl)-, [5R-[5.alpha.,6.beta.(R*)]]-
SpectraBase Compound ID XvYnZzrBkG
InChI InChI=1S/C18H31IO2Si/c1-12(2)14-10-9-13(3)16(20)15(14)17(18(4,5)11-19)21-22(6,7)8/h9,14-15,17H,1,10-11H2,2-8H3/t14-,15+,17+/m0/s1
InChIKey XFJRYPLLJPYSPW-ZMSDIMECSA-N
Mol Weight 434.43 g/mol
Molecular Formula C18H31IO2Si
Exact Mass 434.113802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dc4neujMQL
Name 2-Cyclohexen-1-one, 6-[3-iodo-2,2-dimethyl-1-[(trimethylsilyl)oxy]propyl]-2-methyl-5-(1-methylethenyl)-, [5R-[5.alpha.,6.beta.(R*)]]-
CAS Registry Number 127579-41-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H31IO2Si
InChI InChI=1S/C18H31IO2Si/c1-12(2)14-10-9-13(3)16(20)15(14)17(18(4,5)11-19)21-22(6,7)8/h9,14-15,17H,1,10-11H2,2-8H3/t14-,15+,17+/m0/s1
InChIKey XFJRYPLLJPYSPW-ZMSDIMECSA-N
Molecular Weight 434.433 g/mol
SMILES [C@@]1([C@](C(CI)(C)C)(O[Si](C)(C)C)[H])(C(C(C)=CC[C@]1(C(=C)C)[H])=O)[H]
SPLASH splash10-0w29-0970000000-d6185b6553f7ac10f21a
Source of Spectrum F-45-6108-5
Synonyms (5R,6S)-6-{(1R)-3-iodo-2,2-dimethyl-1-[(trimethylsilyl)oxy]propyl}-5-isopropenyl-2-methyl-2-cyclohexen-1-one E-(4,5)-2-methyl-5-propen-2'-yl-4-(1-trimethylsilyloxy-2,2-dimethyl-3-iodopropyl)cyclohexen-3-one
Wiley ID 1382831