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(1R,2R,5S)-5-(2-hydroxy-1-methoxypropan-2-yl)-2-methyl-3-cyclohexanol
SpectraBase Compound ID BzRqBUP7ybf
InChI InChI=1S/C11H20O3/c1-8-4-5-9(6-10(8)12)11(2,13)7-14-3/h4-5,8-10,12-13H,6-7H2,1-3H3/t8-,9-,10+,11?/m1/s1
InChIKey MLZFIYPDDIPHGG-NFLHVTIKSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfgVCT68l0C
Name (1R,2R,5S)-5-(2-hydroxy-1-methoxypropan-2-yl)-2-methyl-3-cyclohexanol
Alternate Name(s) (1S,2R,5S)-5-[(1S)-1-hydroxy-2-methoxy-1-methylethyl]-2-methyl-3-cyclohexen-1-ol
Comments Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821078
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Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-8-4-5-9(6-10(8)12)11(2,13)7-14-3/h4-5,8-10,12-13H,6-7H2,1-3H3/t8-,9-,10+,11?/m1/s1
InChIKey MLZFIYPDDIPHGG-NFLHVTIKSA-N
Molecular Weight 200.278 g/mol
SMILES O[C@@]1([C@@](C=C[C@@](C(O)(COC)C)(C1)[H])(C)[H])[H]
SPLASH splash10-000i-9200000000-9767833fb59543f71b92
Source of Spectrum E1-39-2521-33
Wiley ID 1519042