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(1R)-(1-2H)-2-(2,5,5-Trimethyl-1,3-dioxan-2-yl)ethan-1-ol
SpectraBase Compound ID 3F5mLZMHqQa
InChI InChI=1S/C9H18O3/c1-8(2)6-11-9(3,4-5-10)12-7-8/h10H,4-7H2,1-3H3/i5D/t5-/m1/s1
InChIKey BZTYJEJBQGKZQZ-QGNIZCMSSA-N
Mol Weight 175.25 g/mol
Molecular Formula C9H17DO3
Exact Mass 175.131871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bqo2PLNM0Tp
Name (1R)-(1-2H)-2-(2,5,5-Trimethyl-1,3-dioxan-2-yl)ethan-1-ol
Appearance Colourless oil
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Formula C9H17DO3
InChI InChI=1S/C9H18O3/c1-8(2)6-11-9(3,4-5-10)12-7-8/h10H,4-7H2,1-3H3/i5D/t5-/m1/s1
InChIKey BZTYJEJBQGKZQZ-QGNIZCMSSA-N
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/anie.201812216
Molecular Weight 175.246 g/mol
SMILES O[C@@](CC1(OCC(CO1)(C)C)C)([D])[H]
SPLASH splash10-01r6-9400000000-1d1ea19545a52b70d23e
Sample Comments 88% ee
Source of Spectrum ACI-58-SM67-(1R)-S22
Thin-Layer Chromatography Rf = 0.33 (cyclohexane/EtOAc, 1:1)
Wiley ID 1840399