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tert-butyl-[(1S,3R,4S)-1-[(1R)-3-iodo-1,2-dimethyl-allyl]-4-methyl-3-triethylsilyloxy-hept-5-ynoxy]-dimethyl-silane
SpectraBase Compound ID 1sieweZpbSY
InChI InChI=1S/C25H49IO2Si2/c1-13-17-20(5)23(28-30(14-2,15-3)16-4)18-24(22(7)21(6)19-26)27-29(11,12)25(8,9)10/h19-20,22-24H,14-16,18H2,1-12H3/t20-,22+,23+,24-/m0/s1
InChIKey IOEOIWRAODENEU-RBVMOCNTSA-N
Mol Weight 564.7 g/mol
Molecular Formula C25H49IO2Si2
Exact Mass 564.231579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XCIZ04sxyi
Name tert-butyl-[(1S,3R,4S)-1-[(1R)-3-iodo-1,2-dimethyl-allyl]-4-methyl-3-triethylsilyloxy-hept-5-ynoxy]-dimethyl-silane
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 564.231578886 u
Formula C25H49IO2Si2
InChI InChI=1S/C25H49IO2Si2/c1-13-17-20(5)23(28-30(14-2,15-3)16-4)18-24(22(7)21(6)19-26)27-29(11,12)25(8,9)10/h19-20,22-24H,14-16,18H2,1-12H3/t20-,22+,23+,24-/m0/s1
InChIKey IOEOIWRAODENEU-RBVMOCNTSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405790
Molecular Weight 564.739 g/mol
Optical Rotation [a]D20 = +6.5 (c = 1.02, C6H6)
Quality 100
Reported Formula C25H49O2Si2I
SMILES [C@@](O[Si](C(C)(C)C)(C)C)(C[C@]([C@@](C)(C#CC)[H])(O[Si](CC)(CC)CC)[H])([C@@](C(=CI)C)(C)[H])[H]
SPLASH splash10-0450-5193000000-1fd0a1a6e27c9f1bc402
Source of Spectrum QE-21-SM11-29 (DOI: 10.1002/chem.201405790)
Wiley ID 1907553