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((2S,3S)-3-Methyl-3-((S)-tetrahydro-2H-pyran-2-yl)oxiran-2-yl)-methanol
SpectraBase Compound ID LNo98gz3qGP
InChI InChI=1S/C9H16O3/c1-9(8(6-10)12-9)7-4-2-3-5-11-7/h7-8,10H,2-6H2,1H3/t7-,8-,9-/m0/s1
InChIKey BPGBLAUMAYTQSO-CIUDSAMLSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 19iw5zti63l
Name ((2S,3S)-3-Methyl-3-((S)-tetrahydro-2H-pyran-2-yl)oxiran-2-yl)-methanol
Appearance Yellow oil
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Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-9(8(6-10)12-9)7-4-2-3-5-11-7/h7-8,10H,2-6H2,1H3/t7-,8-,9-/m0/s1
InChIKey BPGBLAUMAYTQSO-CIUDSAMLSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np5008922
Molecular Weight 172.224 g/mol
Optical Rotation [a]D25 = -21.9 (c = 0.9, CHCl3)
Reported Formula C9H16O3
SMILES OC[C@]1([C@@]([C@]2(OCCCC2)[H])(C)O1)[H]
SPLASH splash10-000i-9300000000-2a3ec6086b66fb50d523
Source of Spectrum G4-78-720-15
Thin-Layer Chromatography Rf = 0.16 (silica gel, n-hexane/EtOAc, 6:4)
Wiley ID 1865843