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(2R,4R)-1,1-Dicyclopropyl-2-methyl-4-((triisopropylsilyl)oxy)pentan-1-ol
SpectraBase Compound ID BIzdDLl9vDb
InChI InChI=1S/C21H42O2Si/c1-14(2)24(15(3)4,16(5)6)23-18(8)13-17(7)21(22,19-9-10-19)20-11-12-20/h14-20,22H,9-13H2,1-8H3/t17-,18-/m1/s1
InChIKey MSTDQVGLUFYDTF-QZTJIDSGSA-N
Mol Weight 354.7 g/mol
Molecular Formula C21H42O2Si
Exact Mass 354.295407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1aBctt60VU
Name (2R,4R)-1,1-Dicyclopropyl-2-methyl-4-((triisopropylsilyl)oxy)pentan-1-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.295407125 u
Formula C21H42O2Si
InChI InChI=1S/C21H42O2Si/c1-14(2)24(15(3)4,16(5)6)23-18(8)13-17(7)21(22,19-9-10-19)20-11-12-20/h14-20,22H,9-13H2,1-8H3/t17-,18-/m1/s1
InChIKey MSTDQVGLUFYDTF-QZTJIDSGSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.202116625
Molecular Weight 354.650 g/mol
Optical Rotation [a]D20 = -12.5 (c = 0.17, CHCl3)
Quality 66
Reported Formula C21H42O2Si
SMILES OC([C@@](C[C@@](C)(O[Si](C(C)C)(C(C)C)C(C)C)[H])(C)[H])(C1CC1)C1CC1
SPLASH splash10-03e9-0900000000-05288c958ab88282f2f9
Sample Comments dr = 99:1, 98% ee
Source of Spectrum ACI-61-SM32-9a (DOI: 10.1002/anie.202116625)
Wiley ID 1897534