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[(1S,2S)-3-methyl-2-phenyl-3-(2-trimethylsilylethynyl)cyclobutyl]methanol
SpectraBase Compound ID gBcUWTZYgp
InChI InChI=1S/C17H24OSi/c1-17(10-11-19(2,3)4)12-15(13-18)16(17)14-8-6-5-7-9-14/h5-9,15-16,18H,12-13H2,1-4H3/t15-,16-,17?/m1/s1
InChIKey UFXCPQIZXSMOJQ-YNPPLXCJSA-N
Mol Weight 272.46 g/mol
Molecular Formula C17H24OSi
Exact Mass 272.159642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uga0gymXpU
Name [(1S,2S)-3-methyl-2-phenyl-3-(2-trimethylsilylethynyl)cyclobutyl]methanol
Appearance Colorless oil
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Formula C17H24OSi
InChI InChI=1S/C17H24OSi/c1-17(10-11-19(2,3)4)12-15(13-18)16(17)14-8-6-5-7-9-14/h5-9,15-16,18H,12-13H2,1-4H3/t15-,16-,17?/m1/s1
InChIKey UFXCPQIZXSMOJQ-YNPPLXCJSA-N
Instrument Name Thermo Scientific DFS-HRMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.202001634
Molecular Weight 272.463 g/mol
Optical Rotation [a]D28 = +44 [c = 1, CH2Cl2)
Reported Formula C17H24OSi
SMILES OC[C@]1(CC([C@@]1(c1ccccc1)[H])(C#C[Si](C)(C)C)C)[H]
SPLASH splash10-001l-7900000000-8ddd0034e1be8912a5b1
Sample Comments dr = 76:24, er = 87:13 (major), er = 94:6 (minor)
Source of Spectrum ACI-59-SM101-S14ad
Thin-Layer Chromatography Rf = 0.25 (P/Et2O, 6:4)
Wiley ID 1857976